List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
308561 |
126497015 |
1 |
ClN3O5H24C26 |
AB3C5D24E26 |
-51.37 |
10.01 |
-8.47 |
-1.46 |
0 |
|
|
308562 |
126497024 |
2 |
NO3C6H10 |
AB3C6D10 |
-290.49 |
7.17 |
-10.23 |
-0.05 |
0 |
|
|
308563 |
126497025 |
1 |
S2N3O11C23H35 |
A2B3C11D23E35 |
-496.19 |
7.13 |
-8.91 |
-0.27 |
0 |
|
|
308564 |
126497026 |
1 |
SN5O11C39H45 |
AB5C11D39E45 |
-396.29 |
8.85 |
-8.51 |
-0.67 |
0 |
|
|
308565 |
126497042 |
1 |
IN3O5H20C25 |
AB3C5D20E25 |
4.31 |
7.63 |
-8.83 |
-1.64 |
0 |
|
|
308566 |
126497044 |
1 |
N3O5H25C26 |
A3B5C25D26 |
-28.72 |
7.56 |
-8.66 |
-1.36 |
0 |
|
|
308567 |
126497045 |
2 |
N2O3H19C21 |
A2B3C19D21 |
-77.16 |
4.42 |
-8.22 |
-0.84 |
0 |
|
|
308568 |
126497049 |
1 |
ClN4O5C29H29 |
AB4C5D29E29 |
-137.56 |
3.54 |
-8.6 |
-0.38 |
0 |
|
|
308569 |
126497057 |
1 |
N5O9C38H43 |
A5B9C38D43 |
-318.27 |
11.48 |
-8.64 |
-0.75 |
0 |
|
|
308570 |
126497058 |
1 |
N5O9C38H45 |
A5B9C38D45 |
-342.31 |
1.31 |
-8.51 |
-0.34 |
0 |
|
|
308571 |
126497061 |
1 |
PN2O3C12H19 |
AB2C3D12E19 |
-123.49 |
5.82 |
-8.85 |
0.01 |
0 |
|
|
308572 |
126497065 |
1 |
NSO3C12H21 |
ABC3D12E21 |
-142.38 |
3.42 |
-10.45 |
-0.99 |
0 |
|
|
308573 |
126497066 |
1 |
N6O7C46H46 |
A6B7C46D46 |
-136.57 |
10.12 |
-7.96 |
-0.83 |
0 |
|
|
308574 |
126497067 |
1 |
PN7O9C53H56 |
AB7C9D53E56 |
-235.05 |
7.87 |
-8.33 |
-0.77 |
0 |
|
|
308575 |
126497068 |
1 |
NSO4C5H13 |
ABC4D5E13 |
-196.0 |
5.4 |
-10.45 |
-0.26 |
0 |
|
|
308584 |
126497089 |
1 |
N2O3H16C24 |
A2B3C16D24 |
-12.06 |
4.68 |
-8.87 |
-0.94 |
0 |
|
|
308587 |
126497094 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-118.62 |
6.74 |
-8.75 |
0.12 |
0 |
|
|
308588 |
126497096 |
1 |
N4O5C29H30 |
A4B5C29D30 |
-112.38 |
7.37 |
-8.6 |
-0.72 |
0 |
|
|
308589 |
126497098 |
1 |
N3O5H23C25 |
A3B5C23D25 |
-56.7 |
3.88 |
-8.7 |
-1.69 |
0 |
|
|
308590 |
126497101 |
1 |
N3O6C19H27 |
A3B6C19D27 |
-260.58 |
1.84 |
-9.25 |
-0.38 |
0 |
|
|
308591 |
126497103 |
2 |
NOH10C15 |
ABC10D15 |
58.98 |
1.9 |
-8.5 |
-0.89 |
0 |
|
|
308597 |
126497119 |
1 |
ClN3O3C14H20 |
AB3C3D14E20 |
-138.9 |
6.9 |
-9.04 |
-0.16 |
0 |
|
|
308598 |
126497124 |
1 |
NSO4C5H13 |
ABC4D5E13 |
-198.05 |
6.66 |
-10.93 |
-0.37 |
0 |
|
|
308600 |
126497132 |
8 |
OC5H8 |
AB5C8 |
-442.04 |
1.47 |
-9.42 |
-0.05 |
0 |
|
|
308601 |
126497133 |
1 |
SN3H27C37 |
AB3C27D37 |
243.34 |
1.81 |
-7.54 |
-0.5 |
0 |
|
|
308603 |
126497136 |
1 |
ClN2O2H23C28 |
AB2C2D23E28 |
3.29 |
2.69 |
-8.53 |
-0.89 |
0 |
|
|
308604 |
126497137 |
2 |
N3C13H14 |
A3B13C14 |
135.2 |
3.86 |
-7.99 |
-0.35 |
0 |
|
|
308605 |
126497138 |
4 |
NC8H8 |
AB8C8 |
124.4 |
4.13 |
-8.39 |
-0.43 |
0 |
|
|
308606 |
126497139 |
2 |
N3H15C16 |
A3B15C16 |
184.4 |
2.02 |
-7.92 |
-0.3 |
0 |
|
|
308607 |
126497140 |
1 |
ON6H36C40 |
AB6C36D40 |
167.18 |
4.13 |
-7.96 |
-0.55 |
0 |
|
|
308608 |
126497141 |
1 |
ON6H30C33 |
AB6C30D33 |
156.31 |
3.11 |
-7.89 |
-0.68 |
0 |
|
|
308609 |
126497143 |
1 |
N3O5C20H31 |
A3B5C20D31 |
-235.3 |
9.36 |
-8.71 |
0.09 |
0 |
|
|
308610 |
126497144 |
1 |
SN3H27C42 |
AB3C27D42 |
248.3 |
3.78 |
-7.98 |
-1.08 |
0 |
|
|
308611 |
126497145 |
1 |
SC13H16 |
AB13C16 |
76.39 |
1.39 |
-8.36 |
-0.12 |
0 |
|
|
308612 |
126497147 |
1 |
SC17H24 |
AB17C24 |
121.71 |
2.48 |
-7.16 |
0.35 |
0 |
|
|
308613 |
126497149 |
1 |
SC23H30 |
AB23C30 |
155.37 |
2.27 |
-7.16 |
0.12 |
0 |
|
|
308614 |
126497150 |
2 |
SH19C22 |
AB19C22 |
240.65 |
3.99 |
-7.18 |
-0.06 |
0 |
|
|
308615 |
126497153 |
1 |
N5C28H33 |
A5B28C33 |
90.69 |
6.85 |
-8.52 |
-0.63 |
0 |
|
|
308616 |
126497154 |
4 |
NC6H6 |
AB6C6 |
108.05 |
4.75 |
-8.41 |
-0.54 |
0 |
|
|
308617 |
126497155 |
2 |
N2C15H18 |
A2B15C18 |
75.91 |
4.17 |
-8.41 |
-0.41 |
0 |
|
|
308619 |
126497162 |
1 |
N5H21C22 |
A5B21C22 |
129.35 |
1.71 |
-8.4 |
-0.7 |
0 |
|
|
308620 |
126497167 |
1 |
N6H34C41 |
A6B34C41 |
261.26 |
6.08 |
-6.83 |
-0.9 |
0 |
|
|
308621 |
126497168 |
1 |
O8C45H68 |
A8B45C68 |
-426.08 |
3.01 |
-9.2 |
-0.02 |
0 |
|
|
308622 |
126497171 |
1 |
SN2O3H8C11 |
AB2C3D8E11 |
-47.64 |
5.14 |
-9.8 |
-1.78 |
0 |
|
|
308623 |
126497172 |
1 |
NSC3O4H9 |
ABC3D4E9 |
-190.68 |
6.33 |
-10.94 |
-0.27 |
0 |
|
|
308624 |
126497174 |
1 |
N3O15C51H67 |
A3B15C51D67 |
-640.57 |
3.79 |
-8.89 |
0.11 |
0 |
|
|
308625 |
126497178 |
1 |
N6O7C47H50 |
A6B7C47D50 |
-111.22 |
9.29 |
-8.11 |
-0.46 |
0 |
|
|
308626 |
126497179 |
1 |
NC10H17 |
AB10C17 |
-5.01 |
1.26 |
-8.38 |
1.38 |
0 |
|
|
308627 |
126497180 |
1 |
NC10H19 |
AB10C19 |
-29.11 |
1.25 |
-8.36 |
2.97 |
0 |
|
|
308628 |
126497181 |
1 |
NC10H19 |
AB10C19 |
-31.11 |
1.62 |
-8.79 |
3.22 |
0 |
|
|
308629 |
126497185 |
1 |
NC10H19 |
AB10C19 |
-17.5 |
1.55 |
-8.71 |
3.15 |
0 |
|
|
308632 |
126497200 |
1 |
SN3H33C35 |
AB3C33D35 |
253.26 |
4.43 |
-7.15 |
-0.82 |
0 |
|
|
308638 |
126497228 |
2 |
NOC21H23 |
ABC21D23 |
30.19 |
2.39 |
-8.39 |
0.18 |
0 |
|
|
308640 |
126497233 |
1 |
NO4C21H25 |
AB4C21D25 |
-106.73 |
1.13 |
-8.85 |
0.0 |
0 |
|
|
308642 |
126497239 |
1 |
SN4H30C36 |
AB4C30D36 |
303.99 |
3.27 |
-7.78 |
-0.83 |
0 |
|
|
308643 |
126497240 |
1 |
NC8H15 |
AB8C15 |
-4.83 |
2.1 |
-9.02 |
2.68 |
0 |
|
|
308644 |
126497241 |
1 |
SC13H14 |
AB13C14 |
31.12 |
2.27 |
-8.01 |
-0.14 |
0 |
|
|
308645 |
126497243 |
2 |
N2C9H10 |
A2B9C10 |
93.01 |
2.38 |
-8.42 |
-0.41 |
0 |
|
|
308647 |
126497250 |
1 |
O11C34H54 |
A11B34C54 |
-555.33 |
4.68 |
-9.78 |
0.57 |
0 |
|
|
308648 |
126497252 |
1 |
SO2C29H54 |
AB2C29D54 |
-179.58 |
1.93 |
-8.21 |
0.16 |
0 |
|
|
308649 |
126497254 |
1 |
N9H71C111 |
A9B71C111 |
588.64 |
4.81 |
-8.26 |
-0.75 |
0 |
|
|
308651 |
126497262 |
1 |
O9C44H66 |
A9B44C66 |
-428.14 |
2.09 |
-9.19 |
0.16 |
0 |
|
|
308660 |
126497290 |
1 |
N5C23H23 |
A5B23C23 |
124.78 |
6.05 |
-8.38 |
-0.7 |
0 |
|
|
308661 |
126497291 |
2 |
N3C17H17 |
A3B17C17 |
164.91 |
4.35 |
-7.99 |
-0.5 |
0 |
|
|
308663 |
126497293 |
1 |
N2O3C26H36 |
A2B3C26D36 |
-87.79 |
1.59 |
-8.34 |
0.45 |
0 |
|
|
308664 |
126497301 |
1 |
N2O3C25H36 |
A2B3C25D36 |
-127.89 |
2.63 |
-8.64 |
0.04 |
0 |
|
|
308666 |
126522362 |
1 |
ClON2C11H23 |
ABC2D11E23 |
-64.8 |
2.85 |
-8.52 |
1.91 |
0 |
|
|
308667 |
126522363 |
1 |
ON2C11H22 |
AB2C11D22 |
-35.49 |
3.42 |
-8.7 |
2.08 |
0 |
|
|
308668 |
126522364 |
1 |
FO2N6H25C30 |
AB2C6D25E30 |
65.1 |
6.11 |
-8.79 |
-2.24 |
0 |
|
|
308669 |
126522365 |
1 |
ClN2O3C18H21 |
AB2C3D18E21 |
-114.23 |
5.83 |
-8.6 |
-0.3 |
0 |
|
|
308670 |
126522366 |
1 |
ClN2O3C18H21 |
AB2C3D18E21 |
-114.03 |
3.57 |
-8.56 |
-0.26 |
0 |
|
|
308671 |
126522367 |
2 |
NOC10H13 |
ABC10D13 |
-69.37 |
3.43 |
-8.16 |
-0.16 |
0 |
|
|
308672 |
126522368 |
1 |
F3O4H11C17 |
A3B4C11D17 |
-229.89 |
4.26 |
-9.66 |
-0.76 |
0 |
|
|
308673 |
126522369 |
1 |
ClN2C14H17 |
AB2C14D17 |
7.8 |
3.1 |
-8.57 |
-0.28 |
0 |
|
|
308674 |
126522370 |
1 |
ClN3O3C20H24 |
AB3C3D20E24 |
-128.82 |
11.79 |
-9.07 |
-0.8 |
0 |