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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
366092 |
127319438 |
1 |
N2S2O5C15H20 |
A2B2C5D15E20 |
-196.08 |
9.2 |
-9.08 |
-0.33 |
0 |
|
|
366093 |
127319439 |
1 |
S2N3O3C15H17 |
A2B3C3D15E17 |
-74.77 |
8.37 |
-9.42 |
-1.44 |
0 |
|
|
366094 |
127319449 |
1 |
S2N3O5C14H21 |
A2B3C5D14E21 |
-175.03 |
9.14 |
-9.45 |
-0.64 |
0 |
|
|
366095 |
127319450 |
1 |
NS2O3C14H19 |
AB2C3D14E19 |
-119.71 |
7.11 |
-8.94 |
-0.41 |
0 |
|
|
366096 |
127319457 |
1 |
N2S2O5C16H22 |
A2B2C5D16E22 |
-173.24 |
8.8 |
-10.18 |
-1.15 |
0 |
|
|
366097 |
127319458 |
1 |
N2S2O5C14H20 |
A2B2C5D14E20 |
-196.07 |
5.43 |
-9.63 |
-0.39 |
0 |
|
|
366098 |
127319459 |
1 |
SN2O4C17H22 |
AB2C4D17E22 |
-151.28 |
6.76 |
-8.99 |
-0.12 |
0 |
|
|
366099 |
127319460 |
1 |
FSN3O3C15H16 |
ABC3D3E15F16 |
-111.36 |
7.7 |
-9.62 |
-1.22 |
0 |
|
|
366100 |
127319461 |
1 |
SN2O4C14H24 |
AB2C4D14E24 |
-199.73 |
5.73 |
-9.23 |
0.78 |
0 |
|
|
366101 |
127319462 |
1 |
SN3O3C16H25 |
AB3C3D16E25 |
-105.99 |
3.69 |
-9.4 |
0.35 |
0 |
|
|
366102 |
127319463 |
1 |
ClN2S2O5C14H19 |
AB2C2D5E14F19 |
-206.11 |
4.98 |
-9.78 |
-0.76 |
0 |
|
|
366103 |
127319464 |
1 |
N3O3S3C15H19 |
A3B3C3D15E19 |
-99.09 |
5.87 |
-8.7 |
-0.93 |
0 |
|
|
366104 |
127319465 |
1 |
NSO5C17H23 |
ABC5D17E23 |
-207.42 |
5.08 |
-9.15 |
-0.23 |
0 |
|
|
366105 |
127319466 |
1 |
N2S2O4C15H22 |
A2B2C4D15E22 |
-170.98 |
4.78 |
-9.41 |
-0.79 |
0 |
|
|
366106 |
127319467 |
1 |
SN2O3C16H20 |
AB2C3D16E20 |
-103.09 |
4.5 |
-8.6 |
-0.09 |
0 |
|
|
366107 |
127319468 |
1 |
BrSN3O3C15H16 |
ABC3D3E15F16 |
-68.72 |
4.33 |
-9.37 |
-0.82 |
0 |
|
|
366108 |
127319469 |
1 |
FN2S2O3C16H17 |
AB2C2D3E16F17 |
-136.64 |
6.14 |
-9.56 |
-1.69 |
0 |
|
|
366109 |
127319470 |
1 |
S2N3O4C14H17 |
A2B3C4D14E17 |
-89.78 |
5.58 |
-9.3 |
-0.95 |
0 |
|
|
366110 |
127319471 |
1 |
SN3O3C14H15 |
AB3C3D14E15 |
-71.26 |
7.19 |
-10.16 |
-1.66 |
0 |
|
|
366111 |
127319472 |
1 |
ClNS2O5C13H16 |
ABC2D5E13F16 |
-207.42 |
7.73 |
-10.4 |
-1.4 |
0 |
|
|
366112 |
127319473 |
1 |
NSO3C12H19 |
ABC3D12E19 |
-142.05 |
7.13 |
-10.14 |
0.72 |
0 |
|
|
366113 |
127319474 |
1 |
S2N3O3C16H21 |
A2B3C3D16E21 |
-93.75 |
8.76 |
-8.64 |
-0.16 |
0 |
|
|
366114 |
127319475 |
1 |
SN2O4C16H30 |
AB2C4D16E30 |
-209.24 |
3.46 |
-8.9 |
0.66 |
0 |
|
|
366115 |
127319476 |
1 |
SN3O3C19H23 |
AB3C3D19E23 |
-73.08 |
8.97 |
-9.19 |
-0.81 |
0 |
|
|
366116 |
127319477 |
1 |
N2S2O4C13H18 |
A2B2C4D13E18 |
-157.69 |
7.2 |
-9.66 |
-1.08 |
0 |
|
|
366117 |
127319478 |
1 |
S2O3N5C11H13 |
A2B3C5D11E13 |
-22.68 |
5.64 |
-9.99 |
-1.96 |
0 |
|
|
366118 |
127319479 |
1 |
SN3O4C18H23 |
AB3C4D18E23 |
-135.29 |
8.73 |
-9.28 |
-1.0 |
0 |
|
|
366119 |
127319480 |
1 |
N2S2O5C14H20 |
A2B2C5D14E20 |
-196.22 |
5.68 |
-10.04 |
-0.5 |
0 |
|
|
366120 |
127319481 |
1 |
SN2O4C19H30 |
AB2C4D19E30 |
-220.05 |
9.49 |
-10.03 |
0.69 |
0 |
|
|
366121 |
127319482 |
1 |
N2S2O4C15H20 |
A2B2C4D15E20 |
-155.74 |
6.86 |
-9.52 |
-0.77 |
0 |
|
|
366122 |
127319483 |
1 |
N2S2O5C16H24 |
A2B2C5D16E24 |
-215.66 |
8.05 |
-9.75 |
-0.46 |
0 |
|
|
366123 |
127319484 |
1 |
NSO3C16H17 |
ABC3D16E17 |
-97.01 |
7.54 |
-9.35 |
-0.98 |
0 |
|
|
366124 |
127319485 |
1 |
SO3N4C15H20 |
AB3C4D15E20 |
-87.83 |
5.81 |
-8.82 |
-0.61 |
0 |
|
|
366125 |
127319486 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-200.57 |
5.85 |
-8.48 |
0.06 |
0 |
|
|
366126 |
127319487 |
1 |
SN2O3C16H18 |
AB2C3D16E18 |
-96.9 |
9.36 |
-9.57 |
-1.15 |
0 |
|
|
366127 |
127319488 |
1 |
SF2N2O4C16H18 |
AB2C2D4E16F18 |
-248.4 |
7.69 |
-9.12 |
-0.56 |
0 |
|
|
366128 |
127319489 |
1 |
FSN3O3C18H20 |
ABC3D3E18F20 |
-108.23 |
10.2 |
-9.34 |
-1.12 |
0 |
|
|
366129 |
127319490 |
1 |
S2N3O3C13H15 |
A2B3C3D13E15 |
-66.52 |
8.75 |
-9.56 |
-1.18 |
0 |
|
|
366130 |
127319491 |
1 |
SN2O4C15H16 |
AB2C4D15E16 |
-85.09 |
6.13 |
-9.77 |
-1.15 |
0 |
|
|
366131 |
127319511 |
1 |
NSO4C15H19 |
ABC4D15E19 |
-162.39 |
4.83 |
-8.87 |
-0.1 |
0 |
|
|
366132 |
127319512 |
1 |
FN2S2O3C15H15 |
AB2C2D3E15F15 |
-121.62 |
9.2 |
-9.9 |
-1.27 |
0 |
|
|
366133 |
127319513 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-127.2 |
3.52 |
-8.25 |
-0.11 |
0 |
|
|
366134 |
127319514 |
1 |
SN3O4C19H31 |
AB3C4D19E31 |
-220.71 |
8.08 |
-9.68 |
0.63 |
0 |
|
|
366135 |
127319515 |
1 |
NS2O3C14H19 |
AB2C3D14E19 |
-126.58 |
3.49 |
-8.5 |
-0.14 |
0 |
|
|
366136 |
127319516 |
1 |
NSO4C18H21 |
ABC4D18E21 |
-150.67 |
7.39 |
-9.18 |
-0.54 |
0 |
|
|
366137 |
127319517 |
1 |
NS2O3C16H23 |
AB2C3D16E23 |
-138.36 |
5.87 |
-8.41 |
0.15 |
0 |
|
|
366138 |
127319540 |
1 |
SN3O3C16H27 |
AB3C3D16E27 |
-146.91 |
5.59 |
-8.81 |
0.6 |
0 |
|
|
366139 |
127319541 |
1 |
SN2O4C15H16 |
AB2C4D15E16 |
-87.79 |
7.76 |
-9.76 |
-1.18 |
0 |
|
|
366140 |
127319542 |
1 |
N2S3O5C11H16 |
A2B3C5D11E16 |
-184.56 |
10.92 |
-9.9 |
-1.44 |
0 |
|
|
366141 |
127319543 |
1 |
ClN2S2O4C15H17 |
AB2C2D4E15F17 |
-170.96 |
6.82 |
-9.17 |
-1.12 |
0 |
|
|
366142 |
127319544 |
1 |
N2S3O5C14H20 |
A2B3C5D14E20 |
-193.03 |
5.87 |
-9.59 |
-1.06 |
0 |
|
|
366143 |
127319545 |
1 |
SN2O4C17H20 |
AB2C4D17E20 |
-135.72 |
4.43 |
-8.87 |
-0.47 |
0 |
|
|
366144 |
127319546 |
1 |
N2S2O5C15H20 |
A2B2C5D15E20 |
-194.24 |
11.9 |
-9.63 |
-0.59 |
0 |
|
|
366145 |
127319547 |
1 |
NSO5C15H19 |
ABC5D15E19 |
-193.6 |
4.28 |
-8.77 |
0.14 |
0 |
|
|
366146 |
127319548 |
1 |
N2S2O3C19H22 |
A2B2C3D19E22 |
-89.13 |
6.39 |
-9.25 |
-0.83 |
0 |
|
|
366147 |
127319549 |
1 |
N2S2O4C15H18 |
A2B2C4D15E18 |
-130.92 |
3.46 |
-8.93 |
-0.81 |
0 |
|
|
366148 |
127319550 |
1 |
FNS2O3C13H16 |
ABC2D3E13F16 |
-163.17 |
6.64 |
-9.38 |
-0.92 |
0 |
|
|
366149 |
127319551 |
1 |
SO3N5C13H15 |
AB3C5D13E15 |
-26.25 |
3.18 |
-10.52 |
-1.57 |
0 |
|
|
366150 |
127319552 |
1 |
SN2O5C18H24 |
AB2C5D18E24 |
-207.58 |
4.85 |
-8.34 |
0.08 |
0 |
|
|
366151 |
127319560 |
1 |
N2S2O4C13H18 |
A2B2C4D13E18 |
-155.8 |
6.79 |
-9.64 |
-0.83 |
0 |
|
|
366152 |
127319561 |
1 |
NSO3C12H19 |
ABC3D12E19 |
-138.1 |
6.68 |
-9.85 |
0.73 |
0 |
|
|
366153 |
127319562 |
1 |
SN3O3C15H17 |
AB3C3D15E17 |
-64.59 |
8.95 |
-9.53 |
-1.01 |
0 |
|
|
366154 |
127319563 |
1 |
N2S2O3C17H20 |
A2B2C3D17E20 |
-95.43 |
6.69 |
-9.64 |
-1.2 |
0 |
|
|
366155 |
127319564 |
1 |
SN3O4C14H23 |
AB3C4D14E23 |
-150.64 |
3.66 |
-10.28 |
-0.17 |
0 |
|
|
366156 |
127319565 |
1 |
FSO3N5C16H20 |
ABC3D5E16F20 |
-93.06 |
10.8 |
-9.61 |
-0.17 |
0 |
|
|
366157 |
127319566 |
1 |
FSO3N5C16H20 |
ABC3D5E16F20 |
-94.26 |
9.22 |
-9.76 |
-0.2 |
0 |
|
|
366158 |
127319567 |
1 |
SN3O3C16H19 |
AB3C3D16E19 |
-75.11 |
4.0 |
-9.36 |
-0.5 |
0 |
|
|
366159 |
127319568 |
1 |
SF2N3O3C18H19 |
AB2C3D3E18F19 |
-156.73 |
6.79 |
-9.53 |
-1.35 |
0 |
|
|
366160 |
127319569 |
1 |
SN3O5C16H19 |
AB3C5D16E19 |
-208.34 |
5.7 |
-9.62 |
-1.15 |
0 |
|
|
366161 |
127319570 |
1 |
N2S2O3C13H18 |
A2B2C3D13E18 |
-110.52 |
8.27 |
-9.28 |
-0.73 |
0 |
|
|
366162 |
127319571 |
1 |
ClSO3N4C17H19 |
ABC3D4E17F19 |
-46.28 |
9.35 |
-9.96 |
-1.13 |
0 |
|
|
366163 |
127319572 |
2 |
NSO2C8H11 |
ABC2D8E11 |
-166.48 |
5.72 |
-9.17 |
-0.29 |
0 |
|
|
366164 |
127319573 |
1 |
FN2S2O3C15H15 |
AB2C2D3E15F15 |
-124.53 |
7.63 |
-9.7 |
-1.73 |
0 |
|
|
366165 |
127319574 |
1 |
SN2O4C16H28 |
AB2C4D16E28 |
-216.55 |
5.95 |
-9.26 |
0.74 |
0 |
|
|
366166 |
127319575 |
1 |
NS2O3C13H17 |
AB2C3D13E17 |
-97.24 |
7.51 |
-9.35 |
-1.0 |
0 |
|
|
366167 |
127319576 |
1 |
NSO3C17H23 |
ABC3D17E23 |
-145.51 |
3.56 |
-8.99 |
0.32 |
0 |
|
|
366168 |
127319577 |
1 |
SN3O5C16H19 |
AB3C5D16E19 |
-206.1 |
8.07 |
-9.63 |
-1.09 |
0 |
|
|
366169 |
127319578 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-203.72 |
5.02 |
-8.74 |
-0.35 |
0 |
|
|
366170 |
127319579 |
1 |
SN3O3C10H13 |
AB3C3D10E13 |
-88.58 |
6.51 |
-10.46 |
-1.5 |
0 |
|
|
366171 |
127319580 |
1 |
N2S2O3C18H22 |
A2B2C3D18E22 |
-107.05 |
3.48 |
-8.67 |
-0.52 |
0 |
|
|
366172 |
127319581 |
1 |
ClSN3O3C15H16 |
ABC3D3E15F16 |
-80.72 |
4.36 |
-9.3 |
-0.8 |
0 |
|
|
366173 |
127319582 |
1 |
SO3N4C15H18 |
AB3C4D15E18 |
-54.09 |
9.33 |
-10.19 |
-0.6 |
0 |
|
|
366174 |
127319583 |
1 |
SN2O3C18H20 |
AB2C3D18E20 |
-98.17 |
4.74 |
-9.54 |
-1.02 |
0 |
|
|
366175 |
127319584 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-52.76 |
3.96 |
-8.92 |
-0.8 |
0 |
|
|
366176 |
127319585 |
1 |
N3S3O4C14H17 |
A3B3C4D14E17 |
-131.71 |
6.67 |
-9.38 |
-1.49 |
0 |
|
|
366177 |
127319586 |
1 |
NS2O3C14H19 |
AB2C3D14E19 |
-127.31 |
2.43 |
-8.92 |
-0.41 |
0 |
|
|
366178 |
127319587 |
1 |
ClNS2O3C14H18 |
ABC2D3E14F18 |
-126.96 |
7.38 |
-9.03 |
-0.73 |
0 |
|
|
366179 |
127319588 |
1 |
N2S2O3C15H18 |
A2B2C3D15E18 |
-103.07 |
8.39 |
-9.5 |
-1.08 |
0 |
|
|
366180 |
127319589 |
1 |
S2N3O3C16H21 |
A2B3C3D16E21 |
-97.84 |
2.6 |
-8.58 |
-0.3 |
0 |
|
|
366181 |
127319590 |
1 |
SN2O4C18H24 |
AB2C4D18E24 |
-175.09 |
7.43 |
-9.13 |
0.33 |
0 |
|
|
366182 |
127319591 |
1 |
ClSN2O4C18H23 |
ABC2D4E18F23 |
-178.19 |
6.52 |
-9.58 |
-0.56 |
0 |
|
|
366183 |
127319592 |
1 |
S2N3O3C15H23 |
A2B3C3D15E23 |
-127.84 |
6.37 |
-8.76 |
-0.54 |
0 |
|
|
366184 |
127319593 |
1 |
S2N3O3C15H17 |
A2B3C3D15E17 |
-75.39 |
5.59 |
-9.64 |
-1.59 |
0 |
|
|
366185 |
127319598 |
1 |
N2S2O5C17H18 |
A2B2C5D17E18 |
-167.99 |
10.98 |
-9.06 |
-1.52 |
0 |
|
|
366186 |
127319599 |
1 |
BrSN2O3C16H19 |
ABC2D3E16F19 |
-106.6 |
6.55 |
-8.34 |
0.02 |
0 |
|
|
366187 |
127319602 |
1 |
SN2O4C15H16 |
AB2C4D15E16 |
-114.12 |
5.38 |
-9.69 |
-1.36 |
0 |
|
|
366188 |
127319603 |
1 |
SN3O3C14H23 |
AB3C3D14E23 |
-132.41 |
5.31 |
-8.87 |
0.65 |
0 |
|
|
366189 |
127319604 |
1 |
SO3N4C18H24 |
AB3C4D18E24 |
-81.32 |
3.65 |
-9.76 |
-0.42 |
0 |
|
|
366190 |
127319605 |
1 |
SN2O4C15H26 |
AB2C4D15E26 |
-212.71 |
3.67 |
-9.33 |
0.57 |
0 |
|
|
366191 |
127319606 |
1 |
SN2O4C14H24 |
AB2C4D14E24 |
-204.29 |
6.17 |
-9.32 |
0.82 |
0 |