List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
142534 |
53051541 |
1 |
ON5C20H23 |
AB5C20D23 |
52.23 |
6.25 |
-8.77 |
-0.85 |
0 |
|
|
142535 |
53051669 |
1 |
ON4C21H22 |
AB4C21D22 |
44.77 |
6.17 |
-8.71 |
-0.84 |
0 |
|
|
142536 |
53052122 |
1 |
OSF3N4H19C20 |
ABC3D4E19F20 |
-111.97 |
3.04 |
-9.16 |
-1.38 |
0 |
|
|
142537 |
53052215 |
1 |
F3O3N5H20C22 |
A3B3C5D20E22 |
-189.44 |
4.96 |
-9.22 |
-1.78 |
0 |
|
|
142538 |
53052834 |
1 |
N2O3C21H24 |
A2B3C21D24 |
-98.9 |
10.88 |
-8.95 |
-0.75 |
0 |
|
|
142539 |
53053252 |
2 |
ON2C10H10 |
AB2C10D10 |
50.19 |
1.96 |
-8.84 |
-0.9 |
0 |
|
|
142540 |
53053563 |
1 |
O4N5C27H29 |
A4B5C27D29 |
-52.82 |
6.07 |
-8.13 |
-0.74 |
0 |
|
|
142541 |
53053628 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-56.22 |
6.31 |
-9.04 |
-0.58 |
0 |
|
|
142542 |
53053855 |
1 |
SO4N6C16H22 |
AB4C6D16E22 |
-75.12 |
9.47 |
-9.19 |
-1.47 |
0 |
|
|
142543 |
53053856 |
1 |
SO3N5C16H21 |
AB3C5D16E21 |
-55.94 |
10.46 |
-9.21 |
-1.54 |
0 |
|
|
142544 |
53053857 |
1 |
SO3N5C14H19 |
AB3C5D14E19 |
-50.94 |
9.39 |
-9.27 |
-1.5 |
0 |
|
|
142545 |
53053858 |
1 |
SO3N6C18H26 |
AB3C6D18E26 |
-56.35 |
9.18 |
-8.98 |
-1.46 |
0 |
|
|
142546 |
53053859 |
1 |
SO3N6C19H28 |
AB3C6D19E28 |
-51.74 |
8.98 |
-8.63 |
-1.53 |
0 |
|
|
142547 |
53054394 |
1 |
SN2O3C20H22 |
AB2C3D20E22 |
-43.04 |
2.8 |
-9.07 |
-0.86 |
0 |
|
|
142548 |
53054449 |
1 |
ClON6C16H17 |
ABC6D16E17 |
98.02 |
8.21 |
-9.0 |
-1.07 |
0 |
|
|
142549 |
53055149 |
1 |
FO2N4H17C18 |
AB2C4D17E18 |
-19.29 |
7.28 |
-8.98 |
-1.3 |
0 |
|
|
142550 |
53055695 |
1 |
F2O2N3H15C18 |
A2B2C3D15E18 |
-61.43 |
3.7 |
-9.67 |
-1.23 |
0 |
|
|
142551 |
53055945 |
1 |
FSN3O3C19H20 |
ABC3D3E19F20 |
-70.75 |
5.55 |
-9.7 |
-1.01 |
0 |
|
|
142552 |
53056059 |
1 |
SN3O4C22H27 |
AB3C4D22E27 |
-62.95 |
6.33 |
-8.96 |
-0.67 |
0 |
|
|
142553 |
53056342 |
1 |
N4O6H22C23 |
A4B6C22D23 |
-102.83 |
10.72 |
-8.83 |
-1.36 |
0 |
|
|
142554 |
53056509 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-33.19 |
8.98 |
-9.17 |
-1.12 |
0 |
|
|
142555 |
53057259 |
1 |
N2S2O3C19H20 |
A2B2C3D19E20 |
-39.28 |
3.86 |
-8.42 |
-0.85 |
0 |
|
|
142556 |
53057262 |
2 |
NSO2C9H10 |
ABC2D9E10 |
-78.62 |
3.96 |
-8.48 |
-0.93 |
0 |
|
|
142557 |
53057292 |
1 |
ClN2S2O3C17H17 |
AB2C2D3E17F17 |
-50.95 |
6.39 |
-8.79 |
-0.9 |
0 |
|
|
142558 |
53057452 |
2 |
NOC11H13 |
ABC11D13 |
-69.13 |
3.89 |
-8.69 |
-0.1 |
0 |
|
|
142559 |
53057453 |
1 |
N2O4C21H22 |
A2B4C21D22 |
-123.09 |
3.94 |
-8.7 |
-0.14 |
0 |
|
|
142560 |
53057868 |
1 |
BrO2N3C19H26 |
AB2C3D19E26 |
-89.63 |
4.69 |
-8.86 |
-0.21 |
0 |
|
|
142561 |
53057909 |
1 |
N3O4C23H29 |
A3B4C23D29 |
-137.56 |
5.21 |
-8.34 |
0.08 |
0 |
|
|
142562 |
53058097 |
1 |
ON3F4H19C23 |
AB3C4D19E23 |
-174.32 |
5.15 |
-8.43 |
-0.97 |
0 |
|
|
142563 |
53058406 |
2 |
ON3H11C13 |
AB3C11D13 |
90.43 |
10.2 |
-9.04 |
-0.59 |
0 |
|
|
142564 |
53058407 |
1 |
FO2N6H19C25 |
AB2C6D19E25 |
51.18 |
10.97 |
-9.08 |
-0.78 |
0 |
|
|
142565 |
53058485 |
2 |
O2N3H13C14 |
A2B3C13D14 |
11.27 |
3.99 |
-8.69 |
-0.79 |
0 |
|
|
142566 |
53058680 |
1 |
FO3N4C22H23 |
AB3C4D22E23 |
-96.35 |
3.16 |
-9.11 |
-1.01 |
0 |
|
|
142567 |
53058681 |
1 |
FO3N4C22H23 |
AB3C4D22E23 |
-95.92 |
3.03 |
-9.26 |
-1.17 |
0 |
|
|
142568 |
53058750 |
2 |
N2O2H11C13 |
A2B2C11D13 |
-33.49 |
4.18 |
-9.04 |
-1.0 |
0 |
|
|
142569 |
53058751 |
1 |
O3N4H24C27 |
A3B4C24D27 |
-15.36 |
2.31 |
-9.14 |
-1.01 |
0 |
|
|
142570 |
53059562 |
1 |
SN3O4C20H27 |
AB3C4D20E27 |
-148.95 |
4.63 |
-8.59 |
-0.35 |
0 |
|
|
142571 |
53059596 |
1 |
SN3O4C19H25 |
AB3C4D19E25 |
-148.58 |
4.31 |
-9.38 |
-0.1 |
0 |
|
|
142572 |
53059597 |
1 |
SN3O5C19H25 |
AB3C5D19E25 |
-181.96 |
4.25 |
-8.41 |
-0.38 |
0 |
|
|
142573 |
53059903 |
1 |
SN2O6C22H24 |
AB2C6D22E24 |
-153.8 |
6.11 |
-8.35 |
-0.98 |
0 |
|
|
142574 |
53059904 |
1 |
SN3O5C24H27 |
AB3C5D24E27 |
-101.7 |
2.95 |
-8.52 |
-0.98 |
0 |
|
|
142575 |
53059905 |
1 |
SN2O7C22H22 |
AB2C7D22E22 |
-175.84 |
3.4 |
-8.95 |
-0.96 |
0 |
|
|
142576 |
53059906 |
1 |
BrFSN2O5H18C20 |
ABCD2E5F18G20 |
-146.66 |
10.49 |
-9.25 |
-1.14 |
0 |
|
|
142577 |
53059907 |
1 |
SN3O5C26H31 |
AB3C5D26E31 |
-115.54 |
5.35 |
-8.7 |
-0.89 |
0 |
|
|
142578 |
53059977 |
1 |
ClSN2O5C22H23 |
ABC2D5E22F23 |
-134.36 |
3.75 |
-8.89 |
-1.01 |
0 |
|
|
142579 |
53060120 |
1 |
SN2O4C23H26 |
AB2C4D23E26 |
-99.05 |
2.9 |
-8.94 |
-0.99 |
0 |
|
|
142580 |
53060373 |
1 |
BrSO2N3H20C21 |
ABC2D3E20F21 |
-7.57 |
4.35 |
-8.87 |
-1.17 |
0 |
|
|
142581 |
53060513 |
1 |
ClSO2N3H18C22 |
ABC2D3E18F22 |
-4.86 |
4.46 |
-8.82 |
-1.12 |
0 |
|
|
142582 |
53060514 |
1 |
ClSO2N3H18C22 |
ABC2D3E18F22 |
3.95 |
4.1 |
-9.07 |
-1.05 |
0 |
|
|
142583 |
53062011 |
1 |
FON4H21C22 |
ABC4D21E22 |
-10.64 |
6.07 |
-9.11 |
-0.56 |
0 |
|
|
142584 |
53062027 |
1 |
BrON4H21C22 |
ABC4D21E22 |
41.9 |
5.24 |
-8.88 |
-0.47 |
0 |
|
|
142585 |
53062095 |
1 |
BrON4C24H25 |
ABC4D24E25 |
19.53 |
3.81 |
-9.02 |
-0.63 |
0 |
|
|
142586 |
53062407 |
1 |
FN3O4H18C23 |
AB3C4D18E23 |
-75.43 |
5.14 |
-9.13 |
-1.42 |
0 |
|
|
142587 |
53062461 |
1 |
O2N4C29H30 |
A2B4C29D30 |
-2.79 |
4.59 |
-8.36 |
-0.7 |
0 |
|
|
142588 |
53063520 |
1 |
O4N7H19C21 |
A4B7C19D21 |
-9.65 |
9.18 |
-8.97 |
-1.53 |
0 |
|
|
142589 |
53063528 |
1 |
ClO4N6H21C23 |
AB4C6D21E23 |
-34.86 |
6.95 |
-8.98 |
-1.27 |
0 |
|
|
142590 |
53063654 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-93.22 |
3.56 |
-8.64 |
-0.32 |
0 |
|
|
142591 |
53063804 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-117.1 |
4.49 |
-9.45 |
-0.41 |
0 |
|
|
142592 |
53063852 |
1 |
ClN3O3C21H22 |
AB3C3D21E22 |
-92.78 |
4.4 |
-8.93 |
-0.67 |
0 |
|
|
142593 |
53063853 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-124.11 |
3.56 |
-9.49 |
-0.38 |
0 |
|
|
142594 |
53063854 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-126.06 |
4.66 |
-9.6 |
-0.32 |
0 |
|
|
142595 |
53063888 |
1 |
N3O4C18H23 |
A3B4C18D23 |
-135.28 |
6.4 |
-9.43 |
-0.07 |
0 |
|
|
142596 |
53064073 |
1 |
SO3N4C21H24 |
AB3C4D21E24 |
-63.39 |
8.94 |
-8.96 |
-0.64 |
0 |
|
|
142597 |
53064157 |
1 |
SF3N4O4C21H23 |
AB3C4D4E21F23 |
-248.96 |
6.72 |
-9.04 |
-1.16 |
0 |
|
|
142598 |
53064158 |
1 |
SF3O3N4C22H25 |
AB3C3D4E22F25 |
-217.92 |
3.76 |
-9.69 |
-1.22 |
0 |
|
|
142599 |
53064213 |
1 |
SN4O4C19H28 |
AB4C4D19E28 |
-141.61 |
6.56 |
-9.51 |
-0.84 |
0 |
|
|
142600 |
53064389 |
1 |
SO3N5C22H33 |
AB3C5D22E33 |
-87.37 |
7.62 |
-9.53 |
-0.92 |
0 |
|
|
142601 |
53064439 |
1 |
SO4N5C18H21 |
AB4C5D18E21 |
-58.59 |
7.09 |
-8.69 |
-1.12 |
0 |
|
|
142602 |
53064493 |
1 |
SO3N8C19H24 |
AB3C8D19E24 |
1.75 |
7.69 |
-9.16 |
-1.03 |
0 |
|
|
142603 |
53064806 |
1 |
SN3O6C22H25 |
AB3C6D22E25 |
-195.29 |
6.98 |
-9.19 |
-1.1 |
0 |
|
|
142604 |
53065240 |
1 |
O3N5H23C24 |
A3B5C23D24 |
0.46 |
3.42 |
-9.12 |
-1.15 |
0 |
|
|
142605 |
53065427 |
1 |
N4O5H20C21 |
A4B5C20D21 |
-80.39 |
7.91 |
-8.63 |
-1.15 |
0 |
|
|
142606 |
53065722 |
1 |
FO2N4H13C17 |
AB2C4D13E17 |
-10.8 |
3.3 |
-8.76 |
-1.29 |
0 |
|
|
142607 |
53066000 |
1 |
O3N7C23H25 |
A3B7C23D25 |
-21.89 |
3.06 |
-8.76 |
-1.25 |
0 |
|
|
142608 |
53066241 |
1 |
N4O5H24C25 |
A4B5C24D25 |
-113.3 |
4.42 |
-8.41 |
-1.29 |
0 |
|
|
142609 |
53066374 |
1 |
S2N3O4C17H19 |
A2B3C4D17E19 |
-113.44 |
4.27 |
-8.57 |
-1.47 |
0 |
|
|
142610 |
53066963 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-108.48 |
4.42 |
-9.31 |
-0.04 |
0 |
|
|
142611 |
53066986 |
1 |
O2N5C23H25 |
A2B5C23D25 |
-14.4 |
5.76 |
-8.43 |
-0.41 |
0 |
|
|
142612 |
53066987 |
1 |
ClO2N5H20C21 |
AB2C5D20E21 |
-5.03 |
5.94 |
-8.81 |
-0.4 |
0 |
|
|
142613 |
53066988 |
1 |
O2N5C23H25 |
A2B5C23D25 |
-12.07 |
3.59 |
-8.59 |
-0.32 |
0 |
|
|
142614 |
53066989 |
1 |
ClO2N5C22H22 |
AB2C5D22E22 |
-16.0 |
5.53 |
-8.67 |
-0.44 |
0 |
|
|
142615 |
53067840 |
1 |
O3N4H18C21 |
A3B4C18D21 |
17.25 |
5.38 |
-9.13 |
-0.81 |
0 |
|
|
142616 |
53067841 |
2 |
ON2C11H12 |
AB2C11D12 |
14.36 |
5.33 |
-8.97 |
-0.71 |
0 |
|
|
142617 |
53067876 |
1 |
FON5H16C21 |
ABC5D16E21 |
53.15 |
4.89 |
-9.76 |
-1.11 |
0 |
|
|
142618 |
53067877 |
1 |
FON5H16C21 |
ABC5D16E21 |
52.52 |
4.64 |
-8.9 |
-1.16 |
0 |
|
|
142619 |
53067878 |
1 |
FON4C19H19 |
ABC4D19E19 |
-1.69 |
3.87 |
-9.61 |
-1.08 |
0 |
|
|
142620 |
53067879 |
1 |
ClFON4H14C21 |
ABCD4E14F21 |
34.44 |
3.52 |
-9.09 |
-1.3 |
0 |
|
|
142621 |
53067880 |
1 |
ClFON4H14C21 |
ABCD4E14F21 |
35.11 |
5.05 |
-8.87 |
-1.28 |
0 |
|
|
142622 |
53068033 |
1 |
S2N3O3C15H15 |
A2B3C3D15E15 |
-27.34 |
6.62 |
-9.09 |
-1.84 |
0 |
|
|
142623 |
53068034 |
1 |
S2N3O5H15C16 |
A2B3C5D15E16 |
-102.28 |
4.05 |
-9.65 |
-1.96 |
0 |
|
|
142624 |
53068281 |
1 |
S2N3O3C18H19 |
A2B3C3D18E19 |
-13.98 |
3.57 |
-9.49 |
-1.77 |
0 |
|
|
142625 |
53068421 |
1 |
ClSN3O6C20H20 |
ABC3D6E20F20 |
-190.59 |
5.97 |
-8.5 |
-1.52 |
0 |
|
|
142626 |
53069088 |
1 |
SF2N2O4C14H14 |
AB2C2D4E14F14 |
-220.37 |
7.81 |
-8.86 |
-0.68 |
0 |
|
|
142627 |
53069089 |
1 |
SN3O4C14H23 |
AB3C4D14E23 |
-159.58 |
5.07 |
-8.41 |
-0.35 |
0 |
|
|
142628 |
53069090 |
1 |
SN3O5C19H25 |
AB3C5D19E25 |
-163.26 |
4.59 |
-8.56 |
-0.36 |
0 |
|
|
142629 |
53069091 |
1 |
SN2O5C12H20 |
AB2C5D12E20 |
-199.79 |
7.21 |
-9.65 |
-0.35 |
0 |
|
|
142630 |
53069263 |
1 |
ClFSO3N4H10C13 |
ABCD3E4F10G13 |
-56.82 |
11.56 |
-8.94 |
-1.7 |
0 |
|
|
142631 |
53069264 |
1 |
FSO3N5C17H18 |
ABC3D5E17F18 |
-44.72 |
10.34 |
-8.15 |
-1.51 |
0 |
|
|
142632 |
53069265 |
1 |
FSO3N4H13C14 |
ABC3D4E13F14 |
-59.04 |
9.11 |
-9.13 |
-1.54 |
0 |
|
|
142633 |
53069266 |
1 |
ClFSO3N4H10C13 |
ABCD3E4F10G13 |
-60.14 |
10.62 |
-8.74 |
-1.67 |
0 |