List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
279450 |
103843971 |
1 |
OSN2C12H22 |
ABC2D12E22 |
-47.62 |
5.33 |
-8.53 |
0.81 |
0 |
|
|
279451 |
103843978 |
1 |
ON2C11H20 |
AB2C11D20 |
-38.89 |
3.88 |
-9.11 |
1.05 |
0 |
|
|
279452 |
103843979 |
1 |
ON2C10H18 |
AB2C10D18 |
-21.02 |
3.36 |
-9.23 |
0.98 |
0 |
|
|
279453 |
103843980 |
1 |
ON2C13H24 |
AB2C13D24 |
-55.22 |
4.27 |
-9.01 |
0.91 |
0 |
|
|
279454 |
103843985 |
1 |
OSN2C12H22 |
ABC2D12E22 |
-50.72 |
4.72 |
-8.73 |
0.62 |
0 |
|
|
279455 |
103843987 |
2 |
NOC6H11 |
ABC6D11 |
-76.74 |
4.71 |
-9.31 |
0.91 |
0 |
|
|
279456 |
103843992 |
1 |
ON2C12H22 |
AB2C12D22 |
-29.39 |
3.84 |
-9.26 |
0.9 |
0 |
|
|
279457 |
103843997 |
1 |
BrON3C10H12 |
ABC3D10E12 |
3.31 |
7.4 |
-9.11 |
-0.6 |
0 |
|
|
279458 |
103844005 |
1 |
ON3C11H17 |
AB3C11D17 |
-4.67 |
6.85 |
-8.93 |
0.83 |
0 |
|
|
279459 |
103844006 |
1 |
OSN3C10H15 |
ABC3D10E15 |
-1.95 |
4.31 |
-9.14 |
-0.61 |
0 |
|
|
279460 |
103844007 |
1 |
OSN3C11H17 |
ABC3D11E17 |
-4.05 |
3.97 |
-9.24 |
-0.6 |
0 |
|
|
279461 |
103844009 |
1 |
ON5C9H15 |
AB5C9D15 |
12.92 |
3.56 |
-9.46 |
0.04 |
0 |
|
|
279462 |
103844010 |
1 |
BrClOH5N5C10 |
ABCD5E5F10 |
113.46 |
3.36 |
-10.06 |
-1.82 |
0 |
|
|
279463 |
103844011 |
1 |
BrClON3H9C14 |
ABCD3E9F14 |
73.57 |
1.62 |
-8.55 |
-1.43 |
0 |
|
|
279464 |
103844013 |
1 |
BrClON3H9C14 |
ABCD3E9F14 |
74.44 |
2.38 |
-8.72 |
-1.49 |
0 |
|
|
279465 |
103844015 |
1 |
N2O2C13H14 |
A2B2C13D14 |
-1.77 |
5.94 |
-9.5 |
-0.8 |
0 |
|
|
279466 |
103844017 |
1 |
ClN3O3H12C13 |
AB3C3D12E13 |
49.84 |
5.64 |
-10.18 |
-2.09 |
0 |
|
|
279467 |
103844020 |
1 |
ClFNO2H11C15 |
ABCD2E11F15 |
-59.17 |
3.81 |
-9.58 |
-1.06 |
0 |
|
|
279468 |
103844031 |
1 |
BrClON3H9C11 |
ABCD3E9F11 |
22.25 |
5.98 |
-9.19 |
-0.9 |
0 |
|
|
279469 |
103844036 |
1 |
BrSF2N2O2C10H13 |
ABC2D2E2F10G13 |
-154.43 |
4.41 |
-9.21 |
-0.77 |
0 |
|
|
279470 |
103844048 |
1 |
NBr2F2O2S2H5C10 |
AB2C2D2E2F5G10 |
-97.19 |
4.47 |
-9.22 |
-1.69 |
0 |
|
|
279471 |
103844049 |
1 |
BrNSF2O2H10C13 |
ABCD2E2F10G13 |
-126.35 |
6.68 |
-9.11 |
-0.88 |
0 |
|
|
279472 |
103844052 |
1 |
BrNSF2O2C11H14 |
ABCD2E2F11G14 |
-168.44 |
4.67 |
-9.25 |
-0.7 |
0 |
|
|
279473 |
103844054 |
1 |
BrNSF2O2C10H12 |
ABCD2E2F10G12 |
-162.32 |
5.7 |
-9.14 |
-0.7 |
0 |
|
|
279474 |
103844057 |
1 |
BrSN2O2F3H6C11 |
ABC2D2E3F6G11 |
-147.16 |
3.73 |
-9.39 |
-1.74 |
0 |
|
|
279475 |
103844058 |
1 |
BrNSF2O2H8C12 |
ABCD2E2F8G12 |
-114.71 |
5.6 |
-9.18 |
-1.03 |
0 |
|
|
279476 |
103844059 |
1 |
BrSF2O2N3H8C10 |
ABC2D2E3F8G10 |
-112.18 |
7.06 |
-9.11 |
-0.58 |
0 |
|
|
279477 |
103844061 |
1 |
BrClNSF2O2H7C12 |
ABCDE2F2G7H12 |
-118.76 |
5.3 |
-9.32 |
-1.25 |
0 |
|
|
279478 |
103844063 |
1 |
BrClSF2O2N3H7C10 |
ABCD2E2F3G7H10 |
-109.78 |
9.65 |
-8.91 |
-0.71 |
0 |
|
|
279479 |
103844066 |
1 |
BrNSO2F3H7C12 |
ABCD2E3F7G12 |
-162.85 |
4.06 |
-9.26 |
-1.25 |
0 |
|
|
279480 |
103844067 |
1 |
BrClNSF2O2H7C12 |
ABCDE2F2G7H12 |
-122.62 |
5.19 |
-9.26 |
-1.32 |
0 |
|
|
279481 |
103844069 |
1 |
BrSF2O2N3H8C10 |
ABC2D2E3F8G10 |
-107.88 |
8.92 |
-8.97 |
-0.49 |
0 |
|
|
279482 |
103844072 |
1 |
NBr2F2O2S2H5C10 |
AB2C2D2E2F5G10 |
-94.94 |
4.96 |
-9.61 |
-1.45 |
0 |
|
|
279483 |
103844078 |
1 |
BrNSF2O2C10H12 |
ABCD2E2F10G12 |
-164.36 |
4.99 |
-9.22 |
-0.65 |
0 |
|
|
279484 |
103844089 |
1 |
BrNSO2F3H7C12 |
ABCD2E3F7G12 |
-160.31 |
4.04 |
-9.3 |
-1.34 |
0 |
|
|
279485 |
103844090 |
1 |
BrSF2O2N3H10C11 |
ABC2D2E3F10G11 |
-118.23 |
10.41 |
-8.82 |
-0.32 |
0 |
|
|
279486 |
103844092 |
1 |
BrSF2N2O2H7C13 |
ABC2D2E2F7G13 |
-80.47 |
2.25 |
-9.37 |
-1.8 |
0 |
|
|
279487 |
103844094 |
1 |
BrNSO2F3H7C12 |
ABCD2E3F7G12 |
-162.45 |
5.89 |
-9.18 |
-1.3 |
0 |
|
|
279488 |
103844098 |
1 |
ON3C15H19 |
AB3C15D19 |
1.9 |
5.44 |
-9.15 |
-0.27 |
0 |
|
|
279489 |
103844105 |
1 |
BrN2O4H11C13 |
AB2C4D11E13 |
-28.68 |
4.57 |
-9.79 |
-1.81 |
0 |
|
|
279490 |
103844106 |
1 |
BrN2O2H11C12 |
AB2C2D11E12 |
-13.6 |
1.86 |
-9.58 |
-1.06 |
0 |
|
|
279491 |
103844109 |
2 |
NOH7C8 |
ABC7D8 |
-3.0 |
1.09 |
-9.36 |
-0.98 |
0 |
|
|
279492 |
103844113 |
2 |
NO2C7H7 |
AB2C7D7 |
-47.42 |
4.53 |
-9.7 |
-1.45 |
0 |
|
|
279493 |
103844114 |
2 |
NO2C7H7 |
AB2C7D7 |
-42.24 |
6.29 |
-9.55 |
-1.42 |
0 |
|
|
279494 |
103844117 |
2 |
NOH7C8 |
ABC7D8 |
5.97 |
1.59 |
-9.26 |
-1.13 |
0 |
|
|
279495 |
103844118 |
2 |
NOC8H8 |
ABC8D8 |
-19.34 |
5.33 |
-9.67 |
-0.78 |
0 |
|
|
279496 |
103844119 |
1 |
FNO4H12C14 |
ABC4D12E14 |
-87.23 |
5.51 |
-9.75 |
-1.59 |
0 |
|
|
279497 |
103844120 |
1 |
N3O4H11C14 |
A3B4C11D14 |
1.45 |
4.36 |
-9.98 |
-2.05 |
0 |
|
|
279498 |
103844121 |
1 |
N2O4H12C13 |
A2B4C12D13 |
-30.71 |
6.4 |
-9.65 |
-1.59 |
0 |
|
|
279499 |
103844139 |
1 |
NO4H13C14 |
AB4C13D14 |
-40.73 |
7.32 |
-9.59 |
-1.26 |
0 |