List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
346584 |
127271088 |
1 |
SN3O5C18H25 |
AB3C5D18E25 |
-194.13 |
3.4 |
-9.84 |
-1.24 |
0 |
|
|
346585 |
127271089 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-81.49 |
5.9 |
-9.78 |
-1.12 |
0 |
|
|
346586 |
127271090 |
1 |
N3O3C16H21 |
A3B3C16D21 |
-72.82 |
5.94 |
-9.74 |
-1.12 |
0 |
|
|
346587 |
127271091 |
1 |
SN2O5C18H26 |
AB2C5D18E26 |
-201.54 |
4.08 |
-9.25 |
-0.92 |
0 |
|
|
346588 |
127271092 |
3 |
NOC7H9 |
ABC7D9 |
-126.45 |
4.22 |
-9.21 |
-0.94 |
0 |
|
|
346589 |
127271093 |
1 |
N2S2O5C16H24 |
A2B2C5D16E24 |
-196.87 |
4.1 |
-9.27 |
-1.23 |
0 |
|
|
346590 |
127271094 |
1 |
NO4C18H25 |
AB4C18D25 |
-170.02 |
2.7 |
-8.61 |
0.15 |
0 |
|
|
346591 |
127271095 |
1 |
N3O4C16H25 |
A3B4C16D25 |
-181.85 |
4.0 |
-9.63 |
-0.08 |
0 |
|
|
346592 |
127271096 |
1 |
N2O3C17H28 |
A2B3C17D28 |
-169.07 |
5.79 |
-9.41 |
0.71 |
0 |
|
|
346593 |
127271097 |
1 |
N3O4C17H27 |
A3B4C17D27 |
-208.67 |
7.01 |
-9.61 |
-0.19 |
0 |
|
|
346594 |
127271098 |
1 |
O4N5C17H25 |
A4B5C17D25 |
-162.04 |
2.95 |
-9.21 |
-0.68 |
0 |
|
|
346595 |
127271099 |
1 |
SN3O5C18H29 |
AB3C5D18E29 |
-200.87 |
4.18 |
-9.54 |
-0.47 |
0 |
|
|
346596 |
127271100 |
1 |
SN3O3C14H19 |
AB3C3D14E19 |
-118.19 |
6.19 |
-9.45 |
-1.32 |
0 |
|
|
346597 |
127271101 |
1 |
N3O4C18H29 |
A3B4C18D29 |
-213.07 |
2.01 |
-9.57 |
0.14 |
0 |
|
|
346598 |
127271102 |
1 |
SN3O3C20H27 |
AB3C3D20E27 |
-136.91 |
4.96 |
-8.9 |
-1.16 |
0 |
|
|
346599 |
127271103 |
1 |
N3O4C13H21 |
A3B4C13D21 |
-186.06 |
6.01 |
-9.52 |
-0.37 |
0 |
|
|
346600 |
127271104 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-75.41 |
2.38 |
-9.54 |
-0.69 |
0 |
|
|
346601 |
127271105 |
1 |
SN3O3C16H23 |
AB3C3D16E23 |
-123.49 |
8.87 |
-9.24 |
-0.81 |
0 |
|
|
346602 |
127271106 |
1 |
N2O4C17H22 |
A2B4C17D22 |
-163.73 |
4.68 |
-8.89 |
-0.43 |
0 |
|
|
346603 |
127271107 |
2 |
NOC10H13 |
ABC10D13 |
-88.15 |
2.18 |
-8.14 |
-0.28 |
0 |
|
|
346604 |
127271108 |
1 |
N3O4C17H27 |
A3B4C17D27 |
-208.46 |
4.14 |
-9.66 |
0.01 |
0 |
|
|
346605 |
127271109 |
1 |
O3N5C16H21 |
A3B5C16D21 |
-64.88 |
2.18 |
-9.54 |
-1.39 |
0 |
|
|
346606 |
127271110 |
1 |
SN2O4C19H28 |
AB2C4D19E28 |
-178.41 |
6.29 |
-9.28 |
-0.6 |
0 |
|
|
346607 |
127271111 |
1 |
SO2N3C15H23 |
AB2C3D15E23 |
-88.82 |
4.64 |
-9.11 |
-0.61 |
0 |
|
|
346608 |
127271112 |
1 |
SN2O5C19H28 |
AB2C5D19E28 |
-213.59 |
5.2 |
-9.29 |
-0.75 |
0 |
|
|
346609 |
127271113 |
1 |
SN2O5C19H28 |
AB2C5D19E28 |
-214.16 |
4.0 |
-9.38 |
-0.82 |
0 |
|
|
346610 |
127271114 |
1 |
SN2O5C18H26 |
AB2C5D18E26 |
-196.53 |
5.9 |
-9.34 |
-1.08 |
0 |
|
|
346611 |
127271115 |
1 |
N2O5C20H26 |
A2B5C20D26 |
-201.53 |
6.02 |
-8.3 |
0.07 |
0 |
|
|
346612 |
127271116 |
1 |
N3O4C16H25 |
A3B4C16D25 |
-201.32 |
4.55 |
-9.6 |
-0.18 |
0 |
|
|
346613 |
127271117 |
1 |
SN2O3C18H22 |
AB2C3D18E22 |
-121.74 |
1.05 |
-8.73 |
-0.45 |
0 |
|
|
346614 |
127271118 |
1 |
N3O4C19H31 |
A3B4C19D31 |
-217.49 |
2.13 |
-9.55 |
0.15 |
0 |
|
|
346615 |
127271119 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-62.96 |
6.68 |
-9.84 |
-0.99 |
0 |
|
|
346616 |
127271120 |
1 |
SN2O3C18H26 |
AB2C3D18E26 |
-130.19 |
2.53 |
-9.22 |
-0.6 |
0 |
|
|
346617 |
127271121 |
1 |
SN2O3C15H24 |
AB2C3D15E24 |
-164.42 |
5.94 |
-8.94 |
0.15 |
0 |
|
|
346618 |
127271122 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-82.73 |
7.29 |
-9.87 |
-1.07 |
0 |
|
|
346619 |
127271123 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-97.42 |
7.02 |
-8.9 |
-0.57 |
0 |
|
|
346620 |
127271124 |
1 |
SN3O3C18H25 |
AB3C3D18E25 |
-138.68 |
2.72 |
-8.79 |
-0.96 |
0 |
|
|
346621 |
127271125 |
1 |
O2S2N3C11H17 |
A2B2C3D11E17 |
-49.15 |
3.99 |
-9.39 |
-1.44 |
0 |
|
|
346622 |
127271126 |
1 |
SN2O3C14H22 |
AB2C3D14E22 |
-154.2 |
3.23 |
-8.85 |
-0.44 |
0 |
|
|
346623 |
127271127 |
1 |
N3O3C16H21 |
A3B3C16D21 |
-66.6 |
5.16 |
-9.66 |
-1.19 |
0 |
|
|
346624 |
127271128 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-55.48 |
3.94 |
-9.51 |
-1.18 |
0 |
|
|
346625 |
127271129 |
1 |
N3O3C16H29 |
A3B3C16D29 |
-180.48 |
5.86 |
-9.48 |
0.56 |
0 |
|
|
346626 |
127271130 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-58.66 |
3.82 |
-8.91 |
-0.84 |
0 |
|
|
346627 |
127271131 |
1 |
N2O5C20H26 |
A2B5C20D26 |
-191.5 |
6.49 |
-9.07 |
-0.42 |
0 |
|
|
346628 |
127271132 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-133.73 |
2.13 |
-8.92 |
-0.62 |
0 |
|
|
346629 |
127271133 |
1 |
SN2O4C19H28 |
AB2C4D19E28 |
-169.5 |
5.57 |
-9.5 |
-0.63 |
0 |
|
|
346630 |
127271134 |
1 |
SN4O4C18H30 |
AB4C4D18E30 |
-173.27 |
10.86 |
-9.0 |
0.16 |
0 |
|
|
346631 |
127271135 |
1 |
NSO4C19H27 |
ABC4D19E27 |
-172.51 |
5.53 |
-9.8 |
-0.89 |
0 |
|
|
346632 |
127271136 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-54.61 |
3.77 |
-9.41 |
0.15 |
0 |
|
|
346633 |
127271137 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-99.17 |
3.46 |
-9.6 |
-0.46 |
0 |
|
|
346634 |
127271138 |
1 |
SN2O4C13H24 |
AB2C4D13E24 |
-196.6 |
6.47 |
-9.5 |
0.19 |
0 |
|
|
346635 |
127271139 |
2 |
ON2C9H15 |
AB2C9D15 |
-89.46 |
3.05 |
-8.9 |
0.92 |
0 |
|
|
346636 |
127271140 |
1 |
N2S2O4C17H26 |
A2B2C4D17E26 |
-165.68 |
5.64 |
-9.52 |
-1.13 |
0 |
|
|
346637 |
127271141 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-43.28 |
2.22 |
-8.72 |
-0.19 |
0 |
|
|
346638 |
127271142 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-65.21 |
5.75 |
-9.38 |
0.06 |
0 |
|
|
346639 |
127271143 |
1 |
N2S2O5C16H24 |
A2B2C5D16E24 |
-188.85 |
8.22 |
-9.38 |
-1.36 |
0 |
|
|
346640 |
127271144 |
1 |
N3O4C15H25 |
A3B4C15D25 |
-187.72 |
5.69 |
-9.51 |
-0.33 |
0 |
|
|
346641 |
127271145 |
1 |
SN3O4C15H23 |
AB3C4D15E23 |
-149.38 |
5.97 |
-9.72 |
-1.17 |
0 |
|
|
346642 |
127271146 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-167.25 |
8.48 |
-8.83 |
1.2 |
0 |
|
|
346643 |
127271147 |
1 |
N3O4C13H19 |
A3B4C13D19 |
-186.25 |
3.8 |
-9.51 |
-1.11 |
0 |
|
|
346644 |
127271148 |
1 |
SN3O4C18H27 |
AB3C4D18E27 |
-162.98 |
4.7 |
-9.57 |
-0.9 |
0 |
|
|
346645 |
127271149 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-118.4 |
2.58 |
-9.62 |
-0.92 |
0 |
|
|
346646 |
127271150 |
1 |
SN2O4C13H24 |
AB2C4D13E24 |
-194.77 |
4.65 |
-9.7 |
0.67 |
0 |
|
|
346647 |
127271151 |
2 |
ON3C9H13 |
AB3C9D13 |
-19.61 |
8.93 |
-9.16 |
-0.93 |
0 |
|
|
346648 |
127271152 |
1 |
S2N3O3C13H21 |
A2B3C3D13E21 |
-114.93 |
5.05 |
-9.42 |
-0.59 |
0 |
|
|
346649 |
127271153 |
1 |
FSN3O4H14C16 |
ABC3D4E14F16 |
-156.8 |
4.74 |
-9.08 |
-1.41 |
0 |
|
|
346650 |
127271154 |
1 |
FN3O5C15H16 |
AB3C5D15E16 |
-223.09 |
5.68 |
-9.13 |
-0.39 |
0 |
|
|
346651 |
127271155 |
1 |
FN2O4C14H15 |
AB2C4D14E15 |
-194.27 |
8.92 |
-9.57 |
-0.84 |
0 |
|
|
346652 |
127271156 |
1 |
FN2O5C17H21 |
AB2C5D17E21 |
-242.74 |
3.16 |
-9.27 |
-0.55 |
0 |
|
|
346653 |
127271157 |
1 |
FN2O5H17C19 |
AB2C5D17E19 |
-221.46 |
7.35 |
-9.0 |
-1.12 |
0 |
|
|
346654 |
127271158 |
1 |
FN2O4C19H25 |
AB2C4D19E25 |
-220.06 |
7.95 |
-9.4 |
-0.67 |
0 |
|
|
346655 |
127271159 |
1 |
FN3O4C18H24 |
AB3C4D18E24 |
-218.95 |
4.04 |
-9.08 |
-0.37 |
0 |
|
|
346656 |
127271160 |
1 |
FN3O3C16H16 |
AB3C3D16E16 |
-104.04 |
3.56 |
-9.04 |
-0.32 |
0 |
|
|
346657 |
127271161 |
1 |
SN3O4C18H27 |
AB3C4D18E27 |
-151.54 |
2.75 |
-8.24 |
0.48 |
0 |
|
|
346658 |
127271162 |
1 |
SO2N4C21H22 |
AB2C4D21E22 |
26.97 |
0.95 |
-9.04 |
-0.73 |
0 |
|
|
346659 |
127271163 |
1 |
ON7C18H23 |
AB7C18D23 |
92.28 |
5.33 |
-8.63 |
-0.74 |
0 |
|
|
346660 |
127271164 |
1 |
N4C15H20 |
A4B15C20 |
42.6 |
5.3 |
-9.13 |
-1.03 |
0 |
|
|
346661 |
127271165 |
1 |
N7C12H13 |
A7B12C13 |
126.57 |
8.98 |
-9.46 |
-1.36 |
0 |
|
|
346662 |
127271166 |
1 |
ON6C18H24 |
AB6C18D24 |
40.13 |
3.67 |
-8.86 |
-0.84 |
0 |
|
|
346663 |
127271167 |
1 |
ON7C19H21 |
AB7C19D21 |
76.68 |
6.66 |
-8.76 |
-0.82 |
0 |
|
|
346664 |
127271168 |
1 |
SO3N5C17H21 |
AB3C5D17E21 |
-87.19 |
6.14 |
-8.26 |
-0.47 |
0 |
|
|
346665 |
127271169 |
1 |
SN6C19H28 |
AB6C19D28 |
66.5 |
5.89 |
-8.6 |
-0.71 |
0 |
|
|
346666 |
127271170 |
2 |
N3C9H13 |
A3B9C13 |
82.4 |
3.5 |
-8.75 |
-0.76 |
0 |
|
|
346667 |
127271171 |
1 |
ON5C16H23 |
AB5C16D23 |
20.82 |
6.33 |
-8.55 |
-0.57 |
0 |
|
|
346668 |
127271172 |
1 |
ON5C15H21 |
AB5C15D21 |
18.28 |
3.96 |
-8.77 |
-0.79 |
0 |
|
|
346669 |
127271173 |
1 |
ON7C19H25 |
AB7C19D25 |
83.61 |
2.78 |
-8.69 |
-0.81 |
0 |
|
|
346670 |
127271174 |
2 |
N3C8H11 |
A3B8C11 |
97.24 |
4.58 |
-8.6 |
-0.74 |
0 |
|
|
346671 |
127271175 |
2 |
N3C10H15 |
A3B10C15 |
50.51 |
3.91 |
-8.73 |
-0.69 |
0 |
|
|
346672 |
127271176 |
1 |
FON5H20C22 |
ABC5D20E22 |
51.78 |
4.77 |
-9.02 |
-0.88 |
0 |
|
|
346673 |
127271177 |
1 |
FON5H20C22 |
ABC5D20E22 |
52.76 |
5.73 |
-9.03 |
-0.97 |
0 |
|
|
346674 |
127271178 |
1 |
SO2N4C15H22 |
AB2C4D15E22 |
-51.05 |
2.3 |
-9.04 |
-1.18 |
0 |
|
|
346675 |
127271179 |
1 |
ON4C15H24 |
AB4C15D24 |
-27.69 |
4.98 |
-8.73 |
0.06 |
0 |
|
|
346676 |
127271180 |
1 |
ON5C14H21 |
AB5C14D21 |
-5.85 |
1.0 |
-8.69 |
-0.26 |
0 |
|
|
346677 |
127271181 |
1 |
SN3O3C17H27 |
AB3C3D17E27 |
-127.65 |
7.59 |
-9.04 |
-0.3 |
0 |
|
|
346678 |
127271182 |
1 |
FO2N4C17H19 |
AB2C4D17E19 |
-65.09 |
4.96 |
-8.9 |
-0.65 |
0 |
|
|
346679 |
127271183 |
1 |
FO2N3H16C18 |
AB2C3D16E18 |
-50.48 |
1.92 |
-8.57 |
-0.77 |
0 |
|
|
346680 |
127271184 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-61.94 |
4.89 |
-8.77 |
-0.9 |
0 |
|
|
346681 |
127271185 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
29.21 |
3.46 |
-8.8 |
-1.04 |
0 |
|
|
346682 |
127271186 |
1 |
ON7C17H23 |
AB7C17D23 |
57.95 |
8.29 |
-8.7 |
-0.36 |
0 |
|
|
346683 |
127271187 |
2 |
ON3C10H15 |
AB3C10D15 |
-39.72 |
4.6 |
-8.71 |
-0.41 |
0 |