List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
373542 |
131316700 |
1 |
ClON3C10H10 |
ABC3D10E10 |
25.67 |
2.27 |
-8.49 |
-0.64 |
0 |
|
|
373543 |
131316747 |
1 |
FSO3H7C10 |
ABC3D7E10 |
-135.76 |
5.51 |
-9.32 |
-1.62 |
0 |
|
|
373544 |
131316774 |
1 |
ClSO3H9C11 |
ABC3D9E11 |
-97.75 |
7.79 |
-9.17 |
-1.1 |
0 |
|
|
373545 |
131316777 |
1 |
ClSO3H9C11 |
ABC3D9E11 |
-99.67 |
8.38 |
-9.25 |
-1.38 |
0 |
|
|
373546 |
131316845 |
1 |
ClNO2F3C9H9 |
ABC2D3E9F9 |
-224.93 |
2.06 |
-9.64 |
-0.93 |
0 |
|
|
373547 |
131316856 |
1 |
ClSN2H5C11 |
ABC2D5E11 |
94.87 |
1.07 |
-9.41 |
-1.88 |
0 |
|
|
373548 |
131316879 |
1 |
ClSN2H5C11 |
ABC2D5E11 |
95.29 |
4.81 |
-9.45 |
-1.82 |
0 |
|
|
373549 |
131316886 |
1 |
ON3H9C11 |
AB3C9D11 |
43.47 |
3.97 |
-9.74 |
-1.46 |
0 |
|
|
373550 |
131316888 |
1 |
BrN2O2C11H13 |
AB2C2D11E13 |
-75.7 |
3.09 |
-8.57 |
-0.5 |
0 |
|
|
373551 |
131316950 |
1 |
N2F3H3O3C7 |
A2B3C3D3E7 |
-149.6 |
2.37 |
-11.28 |
-2.68 |
0 |
|
|
373552 |
131316962 |
1 |
BrFNOH9C10 |
ABCDE9F10 |
-41.17 |
4.71 |
-9.49 |
-0.64 |
0 |
|
|
373553 |
131316989 |
1 |
BrISO2H6C10 |
ABCD2E6F10 |
-27.27 |
4.36 |
-9.36 |
-1.58 |
0 |
|
|
373554 |
131317012 |
1 |
ClNOH2F6C7 |
ABCD2E6F7 |
-322.65 |
1.96 |
-10.67 |
-1.55 |
0 |
|
|
373555 |
131317015 |
1 |
ClNO2C12H14 |
ABC2D12E14 |
-85.47 |
2.73 |
-9.64 |
-0.27 |
0 |
|
|
373556 |
131317028 |
1 |
IN2O2F3H4C8 |
AB2C2D3E4F8 |
-158.56 |
2.49 |
-9.98 |
-1.62 |
0 |
|
|
373557 |
131317058 |
1 |
BrOS2C12H13 |
ABC2D12E13 |
-7.84 |
3.15 |
-8.34 |
-0.71 |
0 |
|
|
373558 |
131317113 |
1 |
ON3H5C8 |
AB3C5D8 |
49.14 |
6.29 |
-9.1 |
-1.18 |
0 |
|
|
373559 |
131317114 |
1 |
ON3H5C8 |
AB3C5D8 |
54.14 |
2.48 |
-9.64 |
-1.28 |
0 |
|
|
373560 |
131317130 |
1 |
FON2C12H13 |
ABC2D12E13 |
-52.47 |
3.09 |
-9.94 |
-1.08 |
0 |
|
|
373561 |
131317202 |
2 |
FNH2O2C4 |
ABC2D2E4 |
-128.09 |
4.63 |
-10.29 |
-2.11 |
0 |
|
|
373562 |
131317275 |
2 |
NOSC5H5 |
ABCD5E5 |
-6.91 |
4.49 |
-8.28 |
-1.49 |
0 |
|
|
373563 |
131317276 |
1 |
BrFN2O2C10H12 |
ABC2D2E10F12 |
-119.89 |
6.15 |
-9.43 |
-0.94 |
0 |
|
|
373564 |
131317325 |
1 |
ClSN2H3O5C7 |
ABC2D3E5F7 |
-59.78 |
9.34 |
-11.03 |
-2.42 |
0 |
|
|
373565 |
131317330 |
1 |
ClSN2H3O5C7 |
ABC2D3E5F7 |
-63.52 |
3.78 |
-11.11 |
-2.92 |
0 |
|
|
373566 |
131317335 |
1 |
ClSN2H3O5C7 |
ABC2D3E5F7 |
-51.21 |
9.41 |
-10.81 |
-2.37 |
0 |
|
|
373567 |
131317350 |
1 |
ClNOC13H14 |
ABCD13E14 |
-24.58 |
1.24 |
-9.27 |
-0.94 |
0 |
|
|
373568 |
131317368 |
1 |
OCl2F3H3C8 |
AB2C3D3E8 |
-176.95 |
2.13 |
-10.46 |
-1.83 |
0 |
|
|
373569 |
131317383 |
1 |
O3F4H6C9 |
A3B4C6D9 |
-317.41 |
2.97 |
-10.13 |
-1.62 |
0 |
|
|
373570 |
131317428 |
1 |
ClON2H5C7 |
ABC2D5E7 |
-0.64 |
4.34 |
-9.04 |
-0.86 |
0 |
|
|
373571 |
131317431 |
1 |
ClFN2H4C7 |
ABC2D4E7 |
-3.16 |
7.28 |
-9.22 |
-0.81 |
0 |
|
|
373572 |
131317449 |
1 |
ClNSO2C10H10 |
ABCD2E10F10 |
-73.8 |
5.21 |
-9.16 |
-1.23 |
0 |
|
|
373573 |
131317454 |
1 |
ON4C7H10 |
AB4C7D10 |
65.21 |
4.2 |
-10.61 |
-0.56 |
0 |
|
|
373574 |
131317465 |
1 |
ClINSH7C11 |
ABCDE7F11 |
70.85 |
1.94 |
-9.08 |
-1.21 |
0 |
|
|
373575 |
131317466 |
1 |
ClINSH7C11 |
ABCDE7F11 |
70.09 |
3.08 |
-9.07 |
-1.32 |
0 |
|
|
373576 |
131317468 |
1 |
ClINSH7C11 |
ABCDE7F11 |
71.98 |
3.19 |
-9.09 |
-1.33 |
0 |
|
|
373577 |
131317474 |
1 |
BrClSO2H6C10 |
ABCD2E6F10 |
-50.72 |
6.03 |
-9.32 |
-1.56 |
0 |
|
|
373578 |
131317479 |
1 |
BrClSO2H6C10 |
ABCD2E6F10 |
-50.57 |
4.43 |
-9.41 |
-1.43 |
0 |
|
|
373579 |
131317488 |
1 |
BrON2F4H5C7 |
ABC2D4E5F7 |
-227.56 |
3.33 |
-9.07 |
-0.91 |
0 |
|
|
373580 |
131317495 |
1 |
BrON2F4H5C7 |
ABC2D4E5F7 |
-225.81 |
4.41 |
-9.13 |
-0.88 |
0 |
|
|
373581 |
131317496 |
1 |
BrClSO2H6C10 |
ABCD2E6F10 |
-51.39 |
5.02 |
-9.37 |
-1.56 |
0 |
|
|
373582 |
131317500 |
1 |
BrNSF2H4C10 |
ABCD2E4F10 |
-27.47 |
4.06 |
-9.44 |
-1.5 |
0 |
|
|
373583 |
131317505 |
1 |
BrNSF2H4C10 |
ABCD2E4F10 |
-23.63 |
6.32 |
-9.49 |
-1.76 |
0 |
|
|
373584 |
131317513 |
1 |
BrNSF2H4C10 |
ABCD2E4F10 |
-20.7 |
5.89 |
-9.4 |
-1.5 |
0 |
|
|
373585 |
131317520 |
1 |
ClNF3C11H11 |
ABC3D11E11 |
-142.67 |
4.44 |
-9.39 |
-0.92 |
0 |
|
|
373586 |
131317529 |
1 |
ON2C12H12 |
AB2C12D12 |
14.96 |
5.43 |
-8.95 |
-0.17 |
0 |
|
|
373587 |
131317548 |
1 |
SO4H8C11 |
AB4C8D11 |
-111.88 |
2.86 |
-8.77 |
-1.24 |
0 |
|
|
373588 |
131317550 |
1 |
BrN3O3H8C9 |
AB3C3D8E9 |
-82.33 |
7.15 |
-9.29 |
-1.05 |
0 |
|
|
373589 |
131317567 |
1 |
ClNO3C11H14 |
ABC3D11E14 |
-110.88 |
3.56 |
-8.82 |
-0.41 |
0 |
|
|
373590 |
131317581 |
1 |
NOC11H15 |
ABC11D15 |
-32.5 |
4.77 |
-8.32 |
0.12 |
0 |
|
|
373591 |
131317615 |
1 |
BrClNSH2F3O4C6 |
ABCDE2F3G4H6 |
-285.54 |
4.04 |
-10.19 |
-2.26 |
0 |