List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
339479 |
127261412 |
1 |
BrNSO3H14C16 |
ABCD3E14F16 |
-53.55 |
4.0 |
-9.57 |
-0.76 |
0 |
|
|
339480 |
127261413 |
1 |
ON3C19H21 |
AB3C19D21 |
38.81 |
4.94 |
-8.72 |
-0.06 |
0 |
|
|
339481 |
127261414 |
2 |
ON2C3H4 |
AB2C3D4 |
20.61 |
4.59 |
-9.02 |
-1.46 |
0 |
|
|
339482 |
127261415 |
1 |
NO2F3H10C12 |
AB2C3D10E12 |
-200.11 |
4.81 |
-9.99 |
-0.8 |
0 |
|
|
339483 |
127261416 |
1 |
N5O5C11H17 |
A5B5C11D17 |
-176.98 |
10.82 |
-8.99 |
-0.48 |
0 |
|
|
339484 |
127261417 |
1 |
SN2O2C8H10 |
AB2C2D8E10 |
-58.87 |
5.23 |
-8.75 |
-0.73 |
0 |
|
|
339485 |
127261418 |
1 |
OC11H12 |
AB11C12 |
-6.72 |
1.41 |
-9.05 |
0.24 |
0 |
|
|
339486 |
127261419 |
1 |
OH14C16 |
AB14C16 |
6.62 |
3.69 |
-8.05 |
-0.27 |
0 |
|
|
339487 |
127261420 |
1 |
OH14C16 |
AB14C16 |
7.09 |
4.38 |
-7.98 |
-0.17 |
0 |
|
|
339488 |
127261421 |
1 |
BrOC10H19 |
ABC10D19 |
-89.93 |
2.3 |
-9.58 |
0.14 |
0 |
|
|
339489 |
127261422 |
1 |
BrOC10H19 |
ABC10D19 |
-90.68 |
2.95 |
-9.75 |
-0.02 |
0 |
|
|
339490 |
127261423 |
1 |
OC9H12 |
AB9C12 |
-16.91 |
1.01 |
-8.77 |
0.66 |
0 |
|
|
339491 |
127261424 |
1 |
OC11H16 |
AB11C16 |
-28.92 |
1.31 |
-8.44 |
0.19 |
0 |
|
|
339492 |
127261425 |
1 |
ClNO3H4C6 |
ABC3D4E6 |
0.96 |
4.72 |
-9.93 |
-1.74 |
0 |
|
|
339493 |
127261426 |
1 |
NO5H17C20 |
AB5C17D20 |
-30.0 |
7.4 |
-8.68 |
-1.1 |
0 |
|
|
339494 |
127261427 |
1 |
OC19H32 |
AB19C32 |
-63.74 |
0.93 |
-9.15 |
0.64 |
0 |
|
|
339495 |
127261428 |
1 |
NCl2O3H5C8 |
AB2C3D5E8 |
6.23 |
5.73 |
-9.55 |
-1.82 |
0 |
|
|
339496 |
127261429 |
1 |
SO2C10H14 |
AB2C10D14 |
-33.74 |
4.96 |
-8.44 |
0.18 |
0 |
|
|
339497 |
127261430 |
1 |
ClNSO6H12C17 |
ABCD6E12F17 |
-46.86 |
3.3 |
-9.04 |
-1.82 |
0 |
|
|
339498 |
127261431 |
1 |
OH10C12 |
AB10C12 |
56.71 |
0.35 |
-8.67 |
-1.18 |
0 |
|
|
339499 |
127261432 |
1 |
BrOSeH11C13 |
ABCD11E13 |
32.38 |
1.29 |
-8.72 |
-0.49 |
0 |
|
|
339500 |
127261433 |
1 |
ClOSeH11C13 |
ABCD11E13 |
19.36 |
1.58 |
-8.68 |
-0.38 |
0 |
|
|
339501 |
127261434 |
1 |
SO3C13H18 |
AB3C13D18 |
-116.18 |
5.33 |
-9.78 |
-0.49 |
0 |
|
|
339502 |
127261435 |
1 |
SO3C13H18 |
AB3C13D18 |
-119.17 |
7.97 |
-9.77 |
-0.56 |
0 |
|
|
339503 |
127261436 |
1 |
SO3C17H24 |
AB3C17D24 |
-117.06 |
5.51 |
-9.44 |
-0.5 |
0 |
|
|
339504 |
127261437 |
1 |
O2C11H14 |
A2B11C14 |
-72.0 |
0.98 |
-9.45 |
0.28 |
0 |
|
|
339505 |
127261438 |
1 |
OSeC12H16 |
ABC12D16 |
-33.77 |
3.36 |
-8.25 |
-0.06 |
0 |
|
|
339506 |
127261439 |
1 |
SO3C18H18 |
AB3C18D18 |
-65.6 |
5.69 |
-9.15 |
-0.52 |
0 |
|
|
339507 |
127261440 |
1 |
SO3C12H16 |
AB3C12D16 |
-114.12 |
5.17 |
-9.81 |
-0.5 |
0 |
|
|
339508 |
127261441 |
1 |
SO3C12H16 |
AB3C12D16 |
-114.77 |
7.93 |
-9.77 |
-0.56 |
0 |
|
|
339509 |
127261442 |
1 |
O5C12H18 |
A5B12C18 |
-214.74 |
4.41 |
-10.53 |
-1.85 |
0 |
|
|
339510 |
127261443 |
1 |
NOBr2H5C7 |
ABC2D5E7 |
6.28 |
3.54 |
-9.86 |
-1.61 |
0 |
|
|
339511 |
127261444 |
1 |
N2O4H10C11 |
A2B4C10D11 |
-88.42 |
3.69 |
-10.6 |
-1.59 |
0 |
|
|
339512 |
127261445 |
1 |
ON4H14C15 |
AB4C14D15 |
53.7 |
3.88 |
-8.58 |
-0.25 |
0 |
|
|
339513 |
127261446 |
1 |
H6O7C8 |
A6B7C8 |
-268.6 |
6.28 |
-11.58 |
-1.17 |
0 |
|
|
339514 |
127261447 |
1 |
O4C13H18 |
A4B13C18 |
-175.52 |
3.11 |
-11.02 |
-0.8 |
0 |
|
|
339515 |
127261505 |
1 |
N7O7C15H25 |
A7B7C15D25 |
-323.42 |
7.17 |
-9.87 |
0.07 |
0 |
|
|
339516 |
127261506 |
1 |
N9O9C19H31 |
A9B9C19D31 |
-401.51 |
10.55 |
-9.93 |
-0.24 |
0 |
|
|
339517 |
127261507 |
4 |
NOC5H8 |
ABC5D8 |
-196.99 |
4.11 |
-9.18 |
-0.2 |
0 |
|
|
339518 |
127261508 |
1 |
N3O3C13H25 |
A3B3C13D25 |
-177.56 |
3.64 |
-9.35 |
0.81 |
0 |
|
|
339519 |
127261509 |
1 |
SN3O4C20H23 |
AB3C4D20E23 |
-131.2 |
2.19 |
-9.09 |
-0.25 |
0 |
|
|
339520 |
127261510 |
2 |
N2O2C8H11 |
A2B2C8D11 |
-170.71 |
3.94 |
-9.55 |
0.06 |
0 |
|
|
339521 |
127261511 |
1 |
N3O6C26H29 |
A3B6C26D29 |
-191.09 |
4.95 |
-8.86 |
-1.13 |
0 |
|
|
339522 |
127261512 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-101.42 |
1.54 |
-8.97 |
-0.5 |
0 |
|
|
339523 |
127261513 |
1 |
NO3C10H11 |
AB3C10D11 |
-94.01 |
4.62 |
-8.71 |
-1.18 |
0 |
|
|
339524 |
127261514 |
1 |
NO3H13C15 |
AB3C13D15 |
-50.16 |
5.07 |
-8.86 |
-1.17 |
0 |
|
|
339525 |
127261515 |
1 |
ClNO3H8C9 |
ABC3D8E9 |
-94.42 |
2.61 |
-8.98 |
-1.5 |
0 |
|
|
339526 |
127261516 |
1 |
ClNO3H12C15 |
ABC3D12E15 |
-59.95 |
5.26 |
-8.9 |
-1.4 |
0 |
|
|
339527 |
127261517 |
1 |
N3O3C6H11 |
A3B3C6D11 |
-99.55 |
5.16 |
-9.31 |
-0.31 |
0 |
|
|
339528 |
127261518 |
1 |
N3O5C9H17 |
A3B5C9D17 |
-233.33 |
8.0 |
-10.05 |
-0.18 |
0 |