List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
4465 |
11447 |
2 |
C4H9 |
A4B9 |
-45.62 |
0.11 |
-10.67 |
4.16 |
0 |
|
|
4466 |
11449 |
2 |
OC4H7 |
AB4C7 |
-96.67 |
0.34 |
-9.78 |
-0.78 |
0 |
|
|
4467 |
11450 |
1 |
OC10H14 |
AB10C14 |
-45.67 |
2.18 |
-8.92 |
0.31 |
0 |
|
|
4468 |
11454 |
1 |
BrC8H9 |
AB8C9 |
11.74 |
2.31 |
-9.54 |
-0.49 |
0 |
|
|
4469 |
11455 |
1 |
OC9H10 |
AB9C10 |
-27.49 |
4.13 |
-9.57 |
-0.5 |
0 |
|
|
4470 |
11456 |
1 |
BrO2H5C7 |
AB2C5D7 |
-55.18 |
4.94 |
-10.22 |
-1.12 |
0 |
|
|
4471 |
11457 |
1 |
BrNO2H4C6 |
ABC2D4E6 |
22.39 |
4.55 |
-10.37 |
-1.67 |
0 |
|
|
4472 |
11459 |
1 |
N2H4O5C6 |
A2B4C5D6 |
-23.93 |
4.71 |
-10.6 |
-2.36 |
0 |
|
|
4473 |
11460 |
1 |
O2C9H10 |
A2B9C10 |
-58.12 |
1.7 |
-9.09 |
-0.6 |
0 |
|
|
4474 |
11465 |
1 |
BrNC8H10 |
ABC8D10 |
25.02 |
4.07 |
-8.33 |
0.16 |
0 |
|
|
4475 |
11466 |
1 |
BrNO2H4C6 |
ABC2D4E6 |
21.87 |
3.79 |
-10.51 |
-1.72 |
0 |
|
|
4476 |
11467 |
1 |
OC10H18 |
AB10C18 |
-78.91 |
2.39 |
-8.98 |
1.45 |
0 |
|
|
4477 |
11469 |
1 |
NO4C6H7 |
AB4C6D7 |
-46.03 |
6.0 |
-10.21 |
-1.38 |
0 |
|
|
4478 |
11470 |
1 |
O3H8C9 |
A3B8C9 |
-98.84 |
3.66 |
-10.63 |
-1.41 |
0 |
|
|
4479 |
11471 |
2 |
NO2H5C7 |
AB2C5D7 |
-66.8 |
3.66 |
-9.85 |
-2.05 |
0 |
|
|
4480 |
11472 |
1 |
NOC6H7 |
ABC6D7 |
-13.61 |
1.81 |
-10.27 |
-0.35 |
0 |
|
|
4481 |
11473 |
1 |
NOH5C6 |
ABC5D6 |
47.15 |
3.26 |
-9.25 |
-1.36 |
0 |
|
|
4482 |
11474 |
1 |
NOC6H7 |
ABC6D7 |
-14.02 |
3.95 |
-9.93 |
-0.42 |
0 |
|
|
4483 |
11476 |
1 |
OC8H10 |
AB8C10 |
-33.44 |
2.75 |
-9.52 |
0.01 |
0 |
|
|
4484 |
11477 |
1 |
ClOH5C7 |
ABC5D7 |
-12.08 |
3.84 |
-9.88 |
-1.06 |
0 |
|
|
4485 |
11478 |
1 |
O3N4C14H20 |
A3B4C14D20 |
-21.0 |
9.66 |
-6.2 |
-1.55 |
0 |
|
|
4486 |
11479 |
1 |
NO3C9H11 |
AB3C9D11 |
-105.55 |
3.33 |
-10.06 |
-0.37 |
0 |
|
|
4487 |
11480 |
1 |
ClON2C9H11 |
ABC2D9E11 |
-30.42 |
6.08 |
-8.99 |
-0.12 |
0 |
|
|
4488 |
11481 |
1 |
BrN2O2C15H17 |
AB2C2D15E17 |
-40.4 |
6.17 |
-7.91 |
-1.32 |
0 |
|
|
4489 |
11483 |
1 |
NCl2O2C9H9 |
AB2C2D9E9 |
-89.13 |
2.07 |
-9.35 |
-0.42 |
0 |
|
|
4490 |
11484 |
1 |
Cl2O3H6C8 |
A2B3C6D8 |
-116.12 |
2.95 |
-10.06 |
-0.99 |
0 |
|
|
4491 |
11485 |
1 |
ClNOC8H8 |
ABCD8E8 |
-29.71 |
2.63 |
-9.05 |
-0.36 |
0 |
|
|
4492 |
11486 |
1 |
NSO4C12H13 |
ABC4D12E13 |
-124.07 |
1.58 |
-8.3 |
-1.07 |
0 |
|
|
4493 |
11496 |
1 |
O3H8C9 |
A3B8C9 |
-91.39 |
4.05 |
-9.52 |
-1.1 |
0 |
|
|
4494 |
11497 |
1 |
ClO3H7C8 |
AB3C7D8 |
-107.28 |
3.93 |
-9.77 |
-0.65 |
0 |
|
|
4496 |
11499 |
1 |
N4C6O9H12 |
A4B6C9D12 |
-103.92 |
1.17 |
-10.01 |
-1.4 |
0 |
|
|
4497 |
11501 |
1 |
NOH11C13 |
ABC11D13 |
28.34 |
2.65 |
-8.67 |
-0.65 |
0 |
|
|
4498 |
11502 |
2 |
H6C7 |
A6B7 |
60.14 |
0.03 |
-8.82 |
-0.38 |
0 |
|
|
4499 |
11503 |
1 |
NC9H13 |
AB9C13 |
16.98 |
1.63 |
-9.02 |
0.39 |
0 |
|
|
4500 |
11505 |
1 |
OC8H10 |
AB8C10 |
-33.56 |
3.09 |
-9.47 |
0.07 |
0 |
|
|
4501 |
11506 |
2 |
OC4H5 |
AB4C5 |
-72.79 |
0.04 |
-9.6 |
-0.09 |
0 |
|
|
4502 |
11507 |
1 |
C7H16 |
A7B16 |
-40.0 |
0.11 |
-10.85 |
4.18 |
0 |
|
|
4503 |
11508 |
1 |
OC6H14 |
AB6C14 |
-76.62 |
2.24 |
-10.3 |
2.8 |
0 |
|
|
4504 |
11509 |
1 |
OC6H12 |
AB6C12 |
-65.85 |
3.17 |
-9.96 |
0.79 |
0 |
|
|
4505 |
11510 |
1 |
NC3O3H7 |
AB3C3D7 |
-106.49 |
1.94 |
-10.28 |
-0.11 |
0 |
|
|
4506 |
11511 |
2 |
C4H9 |
A4B9 |
-46.49 |
0.03 |
-10.76 |
4.11 |
0 |
|
|
4507 |
11512 |
2 |
C4H9 |
A4B9 |
-45.23 |
0.06 |
-10.76 |
4.16 |
0 |
|
|
4508 |
11513 |
1 |
OC7H16 |
AB7C16 |
-85.55 |
2.03 |
-10.29 |
2.93 |
0 |
|
|
4509 |
11514 |
1 |
O2C9H18 |
A2B9C18 |
-131.24 |
2.06 |
-10.68 |
0.91 |
0 |
|
|
4510 |
11521 |
1 |
NO3C4H9 |
AB3C4D9 |
-111.22 |
1.95 |
-10.29 |
-0.13 |
0 |
|
|
4511 |
11526 |
1 |
NC7H9 |
AB7C9 |
14.08 |
2.23 |
-9.35 |
0.09 |
0 |
|
|
4512 |
11527 |
1 |
OC8H18 |
AB8C18 |
-87.07 |
1.93 |
-10.24 |
2.94 |
0 |
|
|
4513 |
11530 |
1 |
ClO2C6H11 |
AB2C6D11 |
-115.52 |
3.03 |
-10.89 |
0.14 |
0 |
|
|
4514 |
11532 |
1 |
NO3C6H13 |
AB3C6D13 |
-121.11 |
1.96 |
-10.29 |
-0.12 |
0 |
|
|
4515 |
11533 |
1 |
BrC3H5 |
AB3C5 |
7.55 |
2.17 |
-9.8 |
0.15 |
0 |