List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
261550 |
103240009 |
1 |
NO3C13H17 |
AB3C13D17 |
-94.72 |
7.0 |
-9.04 |
-0.17 |
0 |
|
|
261551 |
103240046 |
1 |
NO2C13H23 |
AB2C13D23 |
-100.47 |
5.59 |
-9.34 |
-0.01 |
0 |
|
|
261552 |
103240092 |
1 |
NO3C14H25 |
AB3C14D25 |
-164.27 |
5.46 |
-9.28 |
0.59 |
0 |
|
|
261553 |
103240093 |
1 |
NO2C12H21 |
AB2C12D21 |
-94.59 |
7.92 |
-10.29 |
-0.13 |
0 |
|
|
261554 |
103240106 |
1 |
NO2C18H27 |
AB2C18D27 |
-100.09 |
6.35 |
-9.24 |
-0.19 |
0 |
|
|
261555 |
103240148 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-44.5 |
3.84 |
-9.55 |
-0.68 |
0 |
|
|
261556 |
103240165 |
2 |
NOC6H6 |
ABC6D6 |
-14.15 |
9.72 |
-10.26 |
-0.94 |
0 |
|
|
261557 |
103240201 |
1 |
ON4C12H16 |
AB4C12D16 |
4.72 |
4.08 |
-9.58 |
-0.6 |
0 |
|
|
261558 |
103240233 |
1 |
SN3O4C9H13 |
AB3C4D9E13 |
-129.81 |
8.64 |
-10.56 |
-1.52 |
0 |
|
|
261559 |
103240245 |
1 |
NS2O4C9H13 |
AB2C4D9E13 |
-143.6 |
7.82 |
-9.82 |
-1.34 |
0 |
|
|
261560 |
103240316 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-109.57 |
5.19 |
-9.75 |
-0.16 |
0 |
|
|
261561 |
103240343 |
1 |
NO4C11H21 |
AB4C11D21 |
-200.27 |
0.95 |
-9.57 |
0.58 |
0 |
|
|
261562 |
103240456 |
2 |
NOC5H8 |
ABC5D8 |
-99.78 |
6.17 |
-9.43 |
-0.31 |
0 |
|
|
261563 |
103240599 |
1 |
SO2N3C13H19 |
AB2C3D13E19 |
-28.73 |
4.28 |
-8.95 |
-1.51 |
0 |
|
|
261564 |
103240623 |
1 |
N2O3C13H14 |
A2B3C13D14 |
-81.99 |
4.06 |
-9.06 |
-0.64 |
0 |
|
|
261565 |
103240685 |
1 |
N2O2C7H10 |
A2B2C7D10 |
-60.57 |
2.73 |
-8.92 |
-0.46 |
0 |
|
|
261566 |
103240689 |
1 |
N2O2C7H10 |
A2B2C7D10 |
-74.18 |
5.04 |
-9.67 |
-0.62 |
0 |
|
|
261567 |
103240713 |
1 |
N3O3C9H13 |
A3B3C9D13 |
-100.29 |
3.1 |
-8.38 |
-0.73 |
0 |
|
|
261568 |
103240734 |
1 |
BrNO2C17H24 |
ABC2D17E24 |
-92.08 |
5.44 |
-9.18 |
-1.02 |
0 |
|
|
261569 |
103240795 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-61.26 |
5.06 |
-9.09 |
-0.89 |
0 |
|
|
261570 |
103240839 |
1 |
NSO2C14H19 |
ABC2D14E19 |
-54.7 |
2.65 |
-8.43 |
-0.02 |
0 |
|
|
261571 |
103240885 |
2 |
NO2C7H8 |
AB2C7D8 |
-124.7 |
5.88 |
-9.1 |
-0.62 |
0 |
|
|
261572 |
103240897 |
1 |
N2O2F3H13C14 |
A2B2C3D13E14 |
-208.5 |
4.45 |
-9.91 |
-1.01 |
0 |
|
|
261573 |
103240920 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-65.35 |
2.23 |
-8.62 |
-0.9 |
0 |
|
|
261574 |
103241106 |
1 |
BrNSO2C10H14 |
ABCD2E10F14 |
-61.16 |
5.31 |
-9.41 |
-0.53 |
0 |
|
|
261575 |
103241125 |
1 |
BrNSO2C9H10 |
ABCD2E9F10 |
-30.99 |
5.24 |
-9.62 |
-0.77 |
0 |
|
|
261576 |
103241208 |
1 |
N2O3H10C11 |
A2B3C10D11 |
-47.99 |
6.59 |
-9.35 |
-0.76 |
0 |
|
|
261577 |
103241212 |
1 |
O3N4C14H16 |
A3B4C14D16 |
-38.95 |
7.02 |
-9.06 |
-0.78 |
0 |
|
|
261578 |
103241224 |
1 |
NO3C16H21 |
AB3C16D21 |
-99.04 |
4.53 |
-8.59 |
-0.31 |
0 |
|
|
261579 |
103241413 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-59.53 |
4.7 |
-8.95 |
-0.49 |
0 |
|
|
261580 |
103241421 |
1 |
N3O3C8H11 |
A3B3C8D11 |
-46.95 |
4.77 |
-10.12 |
-0.64 |
0 |
|
|
261581 |
103241437 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-53.29 |
6.27 |
-8.98 |
-0.38 |
0 |
|
|
261582 |
103241462 |
1 |
N3O3C8H11 |
A3B3C8D11 |
-52.87 |
3.05 |
-9.45 |
-0.86 |
0 |
|
|
261583 |
103241488 |
1 |
O2N3C10H15 |
A2B3C10D15 |
-53.15 |
4.07 |
-9.04 |
-0.68 |
0 |
|
|
261584 |
103241496 |
2 |
NO2C5H7 |
AB2C5D7 |
-129.59 |
3.0 |
-8.64 |
-0.76 |
0 |
|
|
261585 |
103241510 |
1 |
SN2O5C12H26 |
AB2C5D12E26 |
-249.62 |
3.12 |
-9.1 |
0.48 |
0 |
|
|
261586 |
103241512 |
1 |
SN4O4C12H20 |
AB4C4D12E20 |
-141.14 |
7.42 |
-9.86 |
-1.25 |
0 |
|
|
261587 |
103241518 |
1 |
SN2O5C12H20 |
AB2C5D12E20 |
-192.92 |
2.23 |
-9.15 |
-0.41 |
0 |
|
|
261588 |
103241522 |
1 |
BrSN2O4C10H21 |
ABC2D4E10F21 |
-186.51 |
3.5 |
-8.59 |
-0.61 |
0 |
|
|
261589 |
103241536 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-63.73 |
6.25 |
-9.02 |
-0.54 |
0 |
|
|
261590 |
103241544 |
1 |
SN2O4C14H22 |
AB2C4D14E22 |
-158.79 |
9.83 |
-9.58 |
0.08 |
0 |
|
|
261591 |
103241564 |
1 |
N2O3C9H12 |
A2B3C9D12 |
-79.71 |
4.67 |
-8.52 |
-0.64 |
0 |
|
|
261592 |
103241579 |
1 |
O2N3H9C10 |
A2B3C9D10 |
-20.22 |
3.95 |
-9.66 |
-0.96 |
0 |
|
|
261593 |
103241607 |
2 |
NOC6H9 |
ABC6D9 |
-94.72 |
5.37 |
-9.55 |
-0.44 |
0 |
|
|
261594 |
103241616 |
1 |
N2O3C10H14 |
A2B3C10D14 |
-98.83 |
3.97 |
-9.09 |
-0.65 |
0 |
|
|
261595 |
103241620 |
1 |
NO4C15H17 |
AB4C15D17 |
-114.71 |
4.32 |
-9.22 |
-0.48 |
0 |
|
|
261596 |
103241624 |
1 |
F2O2N3H7C10 |
A2B2C3D7E10 |
-103.72 |
4.83 |
-8.68 |
-1.08 |
0 |
|
|
261597 |
103241626 |
2 |
FNOH3C5 |
ABCD3E5 |
-96.24 |
5.84 |
-9.27 |
-1.07 |
0 |
|
|
261598 |
103241627 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-42.11 |
8.6 |
-9.6 |
-0.71 |
0 |
|
|
261599 |
103241637 |
1 |
N2O3C8H12 |
A2B3C8D12 |
-93.92 |
2.63 |
-9.04 |
-0.62 |
0 |