List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
418395 |
135104512 |
1 |
FNO4C18H26 |
ABC4D18E26 |
-220.33 |
4.79 |
-8.76 |
0.2 |
0 |
|
|
418396 |
135104523 |
1 |
O2N3C20H33 |
A2B3C20D33 |
-89.14 |
1.92 |
-8.84 |
0.21 |
0 |
|
|
418397 |
135104524 |
1 |
NF3O3C13H14 |
AB3C3D13E14 |
-253.22 |
6.29 |
-9.98 |
-0.9 |
0 |
|
|
418398 |
135104525 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-38.57 |
1.77 |
-9.24 |
-0.1 |
0 |
|
|
418399 |
135104526 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-104.1 |
6.5 |
-8.86 |
-0.17 |
0 |
|
|
418400 |
135104527 |
2 |
NO2C8H11 |
AB2C8D11 |
-163.45 |
5.11 |
-9.09 |
-0.7 |
0 |
|
|
418401 |
135104528 |
1 |
SO6N7C32H51 |
AB6C7D32E51 |
-193.85 |
7.15 |
-8.6 |
-0.79 |
0 |
|
|
418402 |
135104545 |
2 |
N3O3C18H26 |
A3B3C18D26 |
-238.04 |
6.69 |
-9.07 |
-0.12 |
0 |
|
|
418403 |
135104555 |
1 |
N5O7C33H43 |
A5B7C33D43 |
-281.31 |
8.92 |
-9.02 |
-0.28 |
0 |
|
|
418404 |
135104572 |
1 |
N2O4C23H24 |
A2B4C23D24 |
-74.09 |
6.33 |
-9.14 |
-0.36 |
0 |
|
|
418405 |
135104575 |
1 |
NO3C19H25 |
AB3C19D25 |
-120.69 |
3.4 |
-8.98 |
-0.04 |
0 |
|
|
418406 |
135104579 |
1 |
SN3O4C12H19 |
AB3C4D12E19 |
-144.04 |
5.03 |
-9.1 |
-0.05 |
0 |
|
|
418407 |
135104580 |
1 |
ClN6O6C39H43 |
AB6C6D39E43 |
-183.6 |
10.09 |
-8.54 |
-0.2 |
0 |
|
|
418408 |
135104581 |
2 |
NO2C9H11 |
AB2C9D11 |
-118.12 |
5.04 |
-8.23 |
-0.53 |
0 |
|
|
418409 |
135104582 |
1 |
O5N6C36H48 |
A5B6C36D48 |
-147.48 |
7.74 |
-9.21 |
-0.63 |
0 |
|
|
418410 |
135104584 |
1 |
FSO3N4C17H21 |
ABC3D4E17F21 |
-117.11 |
2.77 |
-8.63 |
-0.91 |
0 |
|
|
418411 |
135104585 |
1 |
NSO5C17H25 |
ABC5D17E25 |
-224.21 |
4.47 |
-10.03 |
-0.8 |
0 |
|
|
418412 |
135104586 |
1 |
N2S2O3C16H26 |
A2B2C3D16E26 |
-117.54 |
5.32 |
-8.72 |
-0.87 |
0 |
|
|
418413 |
135104587 |
1 |
SO2F3N3C20H20 |
AB2C3D3E20F20 |
-195.18 |
6.42 |
-9.7 |
-1.63 |
0 |
|
|
418414 |
135104588 |
1 |
SN7O7C35H51 |
AB7C7D35E51 |
-225.02 |
6.14 |
-8.78 |
-0.15 |
0 |
|
|
418415 |
135104589 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-67.47 |
2.29 |
-9.66 |
-0.35 |
0 |
|
|
418416 |
135104590 |
1 |
SN3O3C16H21 |
AB3C3D16E21 |
-83.5 |
6.3 |
-8.25 |
0.16 |
0 |
|
|
418417 |
135104645 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-94.62 |
4.44 |
-8.56 |
-0.21 |
0 |
|
|
418418 |
135104646 |
1 |
ON4C18H30 |
AB4C18D30 |
-37.35 |
3.23 |
-8.95 |
-0.15 |
0 |
|
|
418419 |
135104647 |
1 |
N5O7C36H45 |
A5B7C36D45 |
-234.34 |
3.28 |
-8.76 |
-0.83 |
0 |
|
|
418420 |
135104649 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-67.93 |
6.32 |
-9.36 |
-0.46 |
0 |
|
|
418421 |
135104658 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-26.23 |
5.32 |
-8.76 |
-0.2 |
0 |
|
|
418422 |
135104659 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-15.1 |
6.43 |
-8.46 |
0.02 |
0 |
|
|
418423 |
135104660 |
1 |
SN3O3C19H23 |
AB3C3D19E23 |
-72.7 |
6.09 |
-8.93 |
-0.49 |
0 |
|
|
418424 |
135104661 |
1 |
ON7C20H23 |
AB7C20D23 |
71.76 |
5.32 |
-8.53 |
-1.17 |
0 |
|
|
418425 |
135104662 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-178.78 |
7.4 |
-9.72 |
-1.14 |
0 |
|
|
418426 |
135104708 |
1 |
SO3N4C15H20 |
AB3C4D15E20 |
-70.39 |
6.25 |
-9.98 |
-0.43 |
0 |
|
|
418427 |
135104711 |
1 |
OSN5C22H25 |
ABC5D22E25 |
44.16 |
5.69 |
-8.68 |
-0.63 |
0 |
|
|
418428 |
135104712 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-67.8 |
3.26 |
-9.07 |
-0.5 |
0 |
|
|
418429 |
135104713 |
1 |
SF3N3O3C13H18 |
AB3C3D3E13F18 |
-257.84 |
7.84 |
-9.17 |
-0.49 |
0 |
|
|
418430 |
135104719 |
1 |
N3O3C22H27 |
A3B3C22D27 |
-81.22 |
5.1 |
-8.81 |
0.12 |
0 |
|
|
418431 |
135104730 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-42.04 |
4.48 |
-8.89 |
-0.09 |
0 |
|
|
418433 |
135104756 |
1 |
ClNO3C22H24 |
ABC3D22E24 |
-84.35 |
3.15 |
-8.62 |
-0.14 |
0 |
|
|
418434 |
135104771 |
2 |
NOC11H12 |
ABC11D12 |
-39.24 |
7.59 |
-8.98 |
-0.25 |
0 |
|
|
418435 |
135104772 |
2 |
N2O2C8H9 |
A2B2C8D9 |
-12.68 |
5.29 |
-9.44 |
-0.77 |
0 |
|
|
418436 |
135104773 |
1 |
SN3O5C14H21 |
AB3C5D14E21 |
-176.93 |
3.59 |
-9.65 |
-0.66 |
0 |
|
|
418437 |
135104774 |
1 |
NO3C14H25 |
AB3C14D25 |
-167.29 |
3.37 |
-9.21 |
0.95 |
0 |
|
|
418438 |
135104775 |
1 |
OSN4C20H24 |
ABC4D20E24 |
-2.65 |
4.12 |
-8.32 |
-0.34 |
0 |
|
|
418439 |
135104783 |
1 |
O2N5C17H19 |
A2B5C17D19 |
-26.12 |
1.83 |
-9.52 |
-1.21 |
0 |
|
|
418440 |
135104784 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-68.01 |
4.67 |
-8.95 |
-1.0 |
0 |
|
|
418441 |
135104785 |
1 |
O2N6C21H22 |
A2B6C21D22 |
49.26 |
5.54 |
-9.15 |
-0.87 |
0 |
|
|
418442 |
135104786 |
1 |
OSN5C17H25 |
ABC5D17E25 |
-8.66 |
3.67 |
-8.69 |
-0.26 |
0 |
|
|
418443 |
135104800 |
1 |
ClO2N5C14H16 |
AB2C5D14E16 |
-10.45 |
4.52 |
-9.48 |
-1.04 |
0 |
|
|
418444 |
135104801 |
1 |
ClN2O3C18H23 |
AB2C3D18E23 |
-130.6 |
4.38 |
-8.94 |
-0.2 |
0 |
|
|
418445 |
135104822 |
1 |
SO2N4C16H20 |
AB2C4D16E20 |
-40.01 |
3.66 |
-9.07 |
-0.49 |
0 |