List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
123462 |
50848863 |
1 |
SN4O4C24H28 |
AB4C4D24E28 |
-82.31 |
5.47 |
-9.04 |
-0.88 |
0 |
|
|
123463 |
50848941 |
2 |
N2O2C14H17 |
A2B2C14D17 |
-93.41 |
4.58 |
-8.66 |
-0.83 |
0 |
|
|
123464 |
50848942 |
1 |
O2N5C28H35 |
A2B5C28D35 |
-19.47 |
4.35 |
-8.41 |
-0.72 |
0 |
|
|
123465 |
50848943 |
1 |
ClFO2N4C26H28 |
ABC2D4E26F28 |
-73.95 |
3.44 |
-9.12 |
-0.89 |
0 |
|
|
123466 |
50848944 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-83.15 |
4.87 |
-9.12 |
-0.96 |
0 |
|
|
123467 |
50849066 |
1 |
OSN5H15C16 |
ABC5D15E16 |
77.62 |
5.85 |
-9.62 |
-1.1 |
0 |
|
|
123468 |
50849067 |
1 |
OSN3C19H19 |
ABC3D19E19 |
75.97 |
7.86 |
-8.12 |
-0.42 |
0 |
|
|
123469 |
50849122 |
1 |
SO3N4C27H34 |
AB3C4D27E34 |
-66.5 |
7.15 |
-8.92 |
-0.65 |
0 |
|
|
123470 |
50849140 |
1 |
O3N4C24H32 |
A3B4C24D32 |
-92.74 |
2.94 |
-9.11 |
-0.93 |
0 |
|
|
123471 |
50849216 |
1 |
NSO4C12H17 |
ABC4D12E17 |
-160.59 |
3.78 |
-9.38 |
-0.72 |
0 |
|
|
123472 |
50849217 |
1 |
NSO4C11H15 |
ABC4D11E15 |
-156.55 |
4.85 |
-9.47 |
-0.84 |
0 |
|
|
123473 |
50849269 |
1 |
BrCl2N2O2H9C14 |
AB2C2D2E9F14 |
-15.63 |
2.5 |
-8.75 |
-1.23 |
0 |
|
|
123474 |
50849349 |
1 |
ON4C17H22 |
AB4C17D22 |
6.52 |
4.88 |
-9.06 |
-0.76 |
0 |
|
|
123475 |
50849377 |
1 |
ClON4C16H19 |
ABC4D16E19 |
15.33 |
3.64 |
-9.26 |
-1.05 |
0 |
|
|
123476 |
50849590 |
1 |
BrNCl2O3H10C16 |
ABC2D3E10F16 |
-58.11 |
0.72 |
-9.72 |
-1.74 |
0 |
|
|
123477 |
50849669 |
1 |
BrNO2C17H18 |
ABC2D17E18 |
-42.97 |
5.07 |
-9.28 |
-0.9 |
0 |
|
|
123478 |
50849688 |
1 |
BrO3N4H11C16 |
AB3C4D11E16 |
18.57 |
11.26 |
-8.83 |
-1.84 |
0 |
|
|
123479 |
50849699 |
1 |
ClN2O4H7C11 |
AB2C4D7E11 |
-35.47 |
3.93 |
-9.83 |
-2.0 |
0 |
|
|
123480 |
50849700 |
1 |
NCl2O2C14H17 |
AB2C2D14E17 |
-91.12 |
4.53 |
-9.1 |
-0.73 |
0 |
|
|
123481 |
50849701 |
1 |
NCl2O2C12H15 |
AB2C2D12E15 |
-87.52 |
2.8 |
-9.57 |
-0.82 |
0 |
|
|
123482 |
50849702 |
2 |
ON2H8C11 |
AB2C8D11 |
67.31 |
11.3 |
-8.78 |
-1.59 |
0 |
|
|
123483 |
50849797 |
1 |
OSN3H11C14 |
ABC3D11E14 |
51.84 |
3.07 |
-9.34 |
-1.45 |
0 |
|
|
123484 |
50849830 |
1 |
FOSN2H11C15 |
ABCD2E11F15 |
-25.79 |
3.27 |
-9.36 |
-1.27 |
0 |
|
|
123485 |
50849949 |
1 |
FNSH10C17 |
ABCD10E17 |
43.18 |
1.82 |
-9.05 |
-1.1 |
0 |
|
|
123486 |
50849968 |
1 |
SCl2N2O4H16C18 |
AB2C2D4E16F18 |
-126.18 |
9.31 |
-9.12 |
-1.35 |
0 |
|
|
123487 |
50849985 |
1 |
SCl2N2O3H8C10 |
AB2C2D3E8F10 |
-109.82 |
6.75 |
-9.22 |
-1.47 |
0 |
|
|
123488 |
50850075 |
1 |
BrCl2N2O2H11C16 |
AB2C2D2E11F16 |
-15.49 |
4.17 |
-9.51 |
-1.65 |
0 |
|
|
123489 |
50850166 |
1 |
OSN4C5H6 |
ABC4D5E6 |
38.52 |
3.65 |
-9.64 |
-1.01 |
0 |
|
|
123490 |
50850205 |
1 |
NBr2O2C14H17 |
AB2C2D14E17 |
-68.8 |
4.84 |
-9.22 |
-0.73 |
0 |
|
|
123491 |
50850380 |
1 |
N2C15H20 |
A2B15C20 |
32.17 |
4.73 |
-8.6 |
-0.15 |
0 |
|
|
123492 |
50850381 |
2 |
NC8H11 |
AB8C11 |
24.16 |
3.71 |
-8.59 |
-0.14 |
0 |
|
|
123493 |
50850382 |
2 |
NC8H11 |
AB8C11 |
28.27 |
4.78 |
-8.59 |
-0.15 |
0 |
|
|
123494 |
50850383 |
1 |
ON2C16H22 |
AB2C16D22 |
-4.03 |
0.94 |
-8.56 |
0.13 |
0 |
|
|
123495 |
50850384 |
1 |
OSN4H6C10 |
ABC4D6E10 |
105.18 |
7.55 |
-9.77 |
-1.83 |
0 |
|
|
123496 |
50850385 |
1 |
OSN4H6C10 |
ABC4D6E10 |
105.12 |
4.8 |
-9.84 |
-2.04 |
0 |
|
|
123497 |
50850386 |
1 |
SO2N4H6C11 |
AB2C4D6E11 |
82.18 |
2.83 |
-10.0 |
-2.22 |
0 |
|
|
123498 |
50850387 |
1 |
SO2N4H6C11 |
AB2C4D6E11 |
81.64 |
6.1 |
-9.9 |
-2.03 |
0 |
|
|
123499 |
50850527 |
1 |
ON2C18H24 |
AB2C18D24 |
-8.98 |
3.58 |
-8.53 |
-0.26 |
0 |
|
|
123500 |
50850642 |
1 |
NOC12H13 |
ABC12D13 |
-10.0 |
5.47 |
-9.38 |
-0.64 |
0 |
|
|
123501 |
50850855 |
1 |
ClN2O2H9C14 |
AB2C2D9E14 |
63.06 |
9.28 |
-8.22 |
-1.73 |
0 |
|
|
123502 |
50850999 |
1 |
ON2F6H12C16 |
AB2C6D12E16 |
-284.05 |
3.31 |
-8.7 |
-0.65 |
0 |
|
|
123503 |
50851055 |
1 |
ON3C9H13 |
AB3C9D13 |
-20.61 |
4.22 |
-8.43 |
-0.16 |
0 |
|
|
123504 |
50851131 |
2 |
FNOH4C6 |
ABCD4E6 |
-49.2 |
7.01 |
-9.1 |
-1.16 |
0 |
|
|
123505 |
50851375 |
1 |
N4O5C17H18 |
A4B5C17D18 |
-138.94 |
7.73 |
-9.91 |
-1.08 |
0 |
|
|
123506 |
50851423 |
1 |
O3N4H16C18 |
A3B4C16D18 |
-33.47 |
5.18 |
-10.22 |
-1.1 |
0 |
|
|
123507 |
50851424 |
1 |
O3N4H16C18 |
A3B4C16D18 |
-32.3 |
3.09 |
-10.11 |
-1.04 |
0 |
|
|
123508 |
50851447 |
1 |
N3O4C21H25 |
A3B4C21D25 |
-118.01 |
4.16 |
-8.32 |
-0.21 |
0 |
|
|
123509 |
50851548 |
1 |
O3N5C16H19 |
A3B5C16D19 |
-61.59 |
4.33 |
-9.23 |
-0.78 |
0 |
|
|
123510 |
50851879 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-159.11 |
5.1 |
-8.53 |
-0.22 |
0 |
|
|
123511 |
50852036 |
1 |
Cl2N4O4H42C43 |
A2B4C4D42E43 |
-82.8 |
2.82 |
-8.82 |
-0.88 |
0 |
|
|
123512 |
50852053 |
1 |
ClOSN3C19H20 |
ABCD3E19F20 |
3.99 |
1.9 |
-8.24 |
-0.56 |
0 |
|
|
123513 |
50852149 |
1 |
FNSCl2H14C15 |
ABCD2E14F15 |
-13.28 |
2.08 |
-8.87 |
-0.87 |
0 |
|
|
123514 |
50852150 |
1 |
ClOSN3C26H26 |
ABCD3E26F26 |
22.82 |
4.42 |
-8.38 |
-0.51 |
0 |
|
|
123515 |
50852251 |
1 |
OSN3C21H25 |
ABC3D21E25 |
4.11 |
3.98 |
-8.55 |
-0.28 |
0 |
|
|
123516 |
50852252 |
1 |
SO2N3C22H27 |
AB2C3D22E27 |
-38.64 |
3.29 |
-8.57 |
-0.29 |
0 |
|
|
123517 |
50852253 |
1 |
SN2O2C22H24 |
AB2C2D22E24 |
-24.24 |
1.14 |
-8.62 |
-0.51 |
0 |
|
|
123518 |
50852254 |
1 |
SO2N3C24H31 |
AB2C3D24E31 |
-41.9 |
3.57 |
-8.53 |
-0.29 |
0 |
|
|
123519 |
50852255 |
1 |
OSN3C26H27 |
ABC3D26E27 |
35.03 |
2.58 |
-8.44 |
-0.3 |
0 |
|
|
123520 |
50852256 |
1 |
ClNOC16H16 |
ABCD16E16 |
6.08 |
4.31 |
-9.06 |
-0.87 |
0 |
|
|
123521 |
50852273 |
1 |
O3N4C16H26 |
A3B4C16D26 |
-99.75 |
2.37 |
-8.9 |
0.22 |
0 |
|
|
123522 |
50852279 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-30.08 |
5.72 |
-8.75 |
-0.59 |
0 |
|
|
123523 |
50852420 |
1 |
OSN2H20C22 |
ABC2D20E22 |
30.48 |
3.71 |
-8.51 |
-0.26 |
0 |
|
|
123524 |
50852427 |
2 |
NOH12C13 |
ABC12D13 |
7.1 |
3.68 |
-8.82 |
-1.39 |
0 |
|
|
123525 |
50852465 |
1 |
ClFOSH10C14 |
ABCDE10F14 |
-45.46 |
5.14 |
-9.12 |
-1.18 |
0 |
|
|
123526 |
50852466 |
1 |
OCl2N2H24C27 |
AB2C2D24E27 |
22.7 |
5.19 |
-8.61 |
-0.79 |
0 |
|
|
123527 |
50852467 |
1 |
ON4C20H26 |
AB4C20D26 |
-13.78 |
7.7 |
-8.89 |
-0.7 |
0 |
|
|
123528 |
50852500 |
1 |
NO3H25C28 |
AB3C25D28 |
-42.13 |
0.89 |
-8.44 |
-0.63 |
0 |
|
|
123529 |
50852504 |
2 |
NSO4C10H12 |
ABC4D10E12 |
-278.06 |
1.95 |
-8.84 |
-0.71 |
0 |
|
|
123530 |
50852549 |
1 |
NSCl2O3C24H27 |
ABC2D3E24F27 |
-107.64 |
1.69 |
-8.7 |
-0.75 |
0 |
|
|
123531 |
50852550 |
1 |
NO2C21H25 |
AB2C21D25 |
-55.29 |
3.78 |
-8.99 |
0.28 |
0 |
|
|
123532 |
50852551 |
1 |
SH14C17 |
AB14C17 |
50.71 |
2.23 |
-8.16 |
-0.64 |
0 |
|
|
123533 |
50852655 |
1 |
NO6C24H29 |
AB6C24D29 |
-252.75 |
5.78 |
-8.95 |
-0.69 |
0 |
|
|
123534 |
50852656 |
1 |
NSO6H13C16 |
ABC6D13E16 |
-134.48 |
1.68 |
-9.35 |
-1.7 |
0 |
|
|
123535 |
50852806 |
1 |
ClOSN4C11H11 |
ABCD4E11F11 |
21.98 |
3.79 |
-8.87 |
-0.95 |
0 |
|
|
123536 |
50852998 |
1 |
ClFO2N3H13C19 |
ABC2D3E13F19 |
-51.75 |
4.91 |
-9.16 |
-1.17 |
0 |
|
|
123537 |
50852999 |
1 |
O2S2N3C21H21 |
A2B2C3D21E21 |
-40.77 |
4.8 |
-8.63 |
-1.18 |
0 |
|
|
123538 |
50853281 |
1 |
F2N3H7C8 |
A2B3C7D8 |
-30.95 |
2.91 |
-8.46 |
-0.68 |
0 |
|
|
123539 |
50853311 |
1 |
NO2C12H15 |
AB2C12D15 |
-77.73 |
1.39 |
-8.31 |
0.27 |
0 |
|
|
123540 |
50853312 |
1 |
NO2C18H23 |
AB2C18D23 |
-64.28 |
3.51 |
-8.65 |
-0.07 |
0 |
|
|
123541 |
50853313 |
1 |
OCl2N2C13H22 |
AB2C2D13E22 |
-98.43 |
7.74 |
-9.21 |
0.15 |
0 |
|
|
123542 |
50853314 |
1 |
ON2C13H20 |
AB2C13D20 |
-22.44 |
2.55 |
-8.83 |
0.36 |
0 |
|
|
123543 |
50853315 |
1 |
ClFON2C14H20 |
ABCD2E14F20 |
-85.65 |
2.67 |
-8.73 |
-0.5 |
0 |
|
|
123544 |
50853316 |
1 |
ClNOC22H28 |
ABCD22E28 |
-34.89 |
3.56 |
-9.07 |
0.02 |
0 |
|
|
123546 |
50853318 |
1 |
ON2C14H22 |
AB2C14D22 |
-32.87 |
4.14 |
-8.74 |
0.3 |
0 |
|
|
123547 |
50853319 |
1 |
ClNO2C7H14 |
ABC2D7E14 |
-144.39 |
5.42 |
-9.98 |
0.21 |
0 |
|
|
123548 |
50853320 |
2 |
N2O3C10H14 |
A2B3C10D14 |
-187.33 |
6.73 |
-8.54 |
-0.7 |
0 |
|
|
123549 |
50853426 |
1 |
OF3N3H14C15 |
AB3C3D14E15 |
-128.86 |
5.23 |
-8.63 |
-0.41 |
0 |
|
|
123550 |
50853615 |
1 |
O2N3H13C15 |
A2B3C13D15 |
34.88 |
2.28 |
-8.41 |
-0.9 |
0 |
|
|
123551 |
50853896 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
-22.81 |
10.55 |
-8.64 |
-1.43 |
0 |
|
|
123552 |
50853897 |
1 |
ClON2C15H17 |
ABC2D15E17 |
8.64 |
4.95 |
-8.22 |
-0.24 |
0 |
|
|
123553 |
50853898 |
1 |
BrN2C15H17 |
AB2C15D17 |
49.11 |
6.5 |
-8.64 |
-0.26 |
0 |
|
|
123554 |
50853899 |
1 |
ClN2C15H17 |
AB2C15D17 |
37.96 |
6.31 |
-8.55 |
-0.19 |
0 |
|
|
123555 |
50854056 |
1 |
SO2N3C21H21 |
AB2C3D21E21 |
-25.79 |
9.97 |
-8.72 |
-1.4 |
0 |
|
|
123556 |
50854107 |
1 |
OCl2N3H17C19 |
AB2C3D17E19 |
18.54 |
8.02 |
-8.9 |
-1.11 |
0 |
|
|
123557 |
50854151 |
2 |
NC9H9 |
AB9C9 |
78.06 |
7.83 |
-8.7 |
-0.28 |
0 |
|
|
123558 |
50854152 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
0.71 |
5.03 |
-8.33 |
-0.72 |
0 |
|
|
123559 |
50854153 |
1 |
OSN3C21H23 |
ABC3D21E23 |
22.84 |
6.04 |
-8.38 |
-0.71 |
0 |
|
|
123560 |
50854154 |
1 |
N4H18C19 |
A4B18C19 |
103.94 |
5.3 |
-8.53 |
-0.83 |
0 |
|
|
123561 |
50854169 |
1 |
NO2H17C19 |
AB2C17D19 |
-10.25 |
4.69 |
-8.94 |
-0.8 |
0 |
|
|
123562 |
50854170 |
1 |
FOSN3H18C19 |
ABCD3E18F19 |
-6.66 |
8.13 |
-8.6 |
-0.87 |
0 |