List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
50437 |
12012974 |
1 |
SN2O3H14C16 |
AB2C3D14E16 |
-52.01 |
4.67 |
-8.47 |
-1.08 |
0 |
|
|
50438 |
12012975 |
1 |
N2O4H16C19 |
A2B4C16D19 |
-75.71 |
4.25 |
-8.83 |
-0.95 |
0 |
|
|
50439 |
12012976 |
1 |
BrN2O4H15C19 |
AB2C4D15E19 |
-71.01 |
4.71 |
-8.85 |
-1.21 |
0 |
|
|
50440 |
12012977 |
1 |
N2O6H20C21 |
A2B6C20D21 |
-151.79 |
6.44 |
-8.61 |
-0.88 |
0 |
|
|
50441 |
12012978 |
1 |
SN2O4H14C17 |
AB2C4D14E17 |
-70.17 |
4.48 |
-8.8 |
-1.2 |
0 |
|
|
50442 |
12012979 |
1 |
O2C15H20 |
A2B15C20 |
-82.51 |
1.73 |
-9.46 |
0.26 |
0 |
|
|
50443 |
12012980 |
2 |
OC5H9 |
AB5C9 |
-116.02 |
3.2 |
-9.59 |
0.93 |
0 |
|
|
50444 |
12012981 |
2 |
OC8H11 |
AB8C11 |
-79.23 |
2.38 |
-9.51 |
0.21 |
0 |
|
|
50445 |
12012982 |
2 |
OC8H11 |
AB8C11 |
-80.75 |
1.87 |
-9.46 |
0.26 |
0 |
|
|
50446 |
12012984 |
1 |
O2C15H20 |
A2B15C20 |
-61.29 |
1.9 |
-9.45 |
0.25 |
0 |
|
|
50447 |
12012985 |
2 |
OC5H9 |
AB5C9 |
-94.43 |
1.54 |
-9.91 |
1.97 |
0 |
|
|
50448 |
12012986 |
2 |
OC8H11 |
AB8C11 |
-65.62 |
2.56 |
-9.54 |
0.06 |
0 |
|
|
50449 |
12012987 |
2 |
OC8H11 |
AB8C11 |
-65.28 |
2.27 |
-9.57 |
0.05 |
0 |
|
|
50450 |
12012988 |
2 |
OC6H11 |
AB6C11 |
-96.4 |
1.97 |
-9.71 |
2.09 |
0 |
|
|
50451 |
12012989 |
1 |
NSeO2C18H25 |
ABC2D18E25 |
-77.34 |
4.32 |
-8.47 |
-0.25 |
0 |
|
|
50452 |
12012990 |
1 |
NSeO2C23H33 |
ABC2D23E33 |
-96.37 |
3.44 |
-8.49 |
-0.22 |
0 |
|
|
50453 |
12012991 |
1 |
NSeO2C20H27 |
ABC2D20E27 |
-79.77 |
5.88 |
-8.54 |
-0.28 |
0 |
|
|
50454 |
12012992 |
1 |
NSeO2C18H25 |
ABC2D18E25 |
-71.69 |
3.99 |
-8.75 |
-0.86 |
0 |
|
|
50455 |
12012993 |
1 |
NSeO2C18H25 |
ABC2D18E25 |
-64.5 |
5.24 |
-8.69 |
-0.78 |
0 |
|
|
50457 |
12012995 |
1 |
NSeO2C18H25 |
ABC2D18E25 |
-79.14 |
4.0 |
-8.56 |
-0.34 |
0 |
|
|
50458 |
12012996 |
1 |
NSeO2C17H23 |
ABC2D17E23 |
-33.02 |
3.53 |
-8.7 |
-0.27 |
0 |
|
|
50459 |
12012997 |
1 |
NSeO2C21H29 |
ABC2D21E29 |
-56.9 |
8.08 |
-8.62 |
-0.67 |
0 |
|
|
50460 |
12012998 |
1 |
NSeO2C21H29 |
ABC2D21E29 |
-57.68 |
6.01 |
-8.92 |
-0.97 |
0 |
|
|
50461 |
12013000 |
1 |
NSeO2C21H29 |
ABC2D21E29 |
-51.81 |
7.26 |
-8.6 |
-0.67 |
0 |
|
|
50463 |
12013002 |
1 |
NSeO2C23H33 |
ABC2D23E33 |
-90.56 |
1.89 |
-8.22 |
0.0 |
0 |
|
|
50464 |
12013004 |
1 |
NO2C19H31 |
AB2C19D31 |
-114.44 |
3.36 |
-9.46 |
0.5 |
0 |
|
|
50465 |
12013005 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-110.58 |
5.09 |
-9.44 |
-0.29 |
0 |
|
|
50466 |
12013006 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-150.3 |
6.9 |
-8.99 |
-0.06 |
0 |
|
|
50467 |
12013007 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-147.19 |
3.59 |
-8.99 |
-0.05 |
0 |
|
|
50468 |
12013009 |
2 |
NO3C11H12 |
AB3C11D12 |
-174.73 |
5.28 |
-8.7 |
-0.34 |
0 |
|
|
50469 |
12013010 |
6 |
O2C4H5 |
A2B4C5 |
-490.74 |
3.63 |
-9.93 |
-0.41 |
0 |
|
|
50470 |
12013011 |
2 |
O4H27C32 |
A4B27C32 |
-109.59 |
3.52 |
-9.43 |
-0.34 |
0 |
|
|
50471 |
12013012 |
1 |
NO9H65C69 |
AB9C65D69 |
-193.77 |
1.99 |
-8.99 |
-0.28 |
0 |
|
|
50472 |
12013013 |
1 |
NO9H63C71 |
AB9C63D71 |
-140.73 |
2.79 |
-8.91 |
-0.22 |
0 |
|
|
50473 |
12013014 |
1 |
NO9H65C72 |
AB9C65D72 |
-142.61 |
3.21 |
-9.04 |
-0.35 |
0 |
|
|
50474 |
12013015 |
1 |
NO9H67C70 |
AB9C67D70 |
-199.43 |
3.15 |
-9.02 |
-0.31 |
0 |
|
|
50475 |
12013016 |
1 |
NO9H69C71 |
AB9C69D71 |
-196.02 |
6.07 |
-8.94 |
-0.24 |
0 |
|
|
50476 |
12013017 |
1 |
NO9H69C71 |
AB9C69D71 |
-197.65 |
6.32 |
-9.2 |
-0.49 |
0 |
|
|
50477 |
12013018 |
2 |
O4H28C31 |
A4B28C31 |
-155.96 |
3.44 |
-9.32 |
-0.07 |
0 |
|
|
50478 |
12013019 |
1 |
NO9H69C71 |
AB9C69D71 |
-205.88 |
5.76 |
-9.1 |
-0.4 |
0 |
|
|
50479 |
12013020 |
1 |
NOC9H13 |
ABC9D13 |
-40.06 |
4.15 |
-8.95 |
-0.26 |
0 |
|
|
50480 |
12013021 |
1 |
NO9H69C71 |
AB9C69D71 |
-191.02 |
6.04 |
-8.99 |
-0.35 |
0 |
|
|
50481 |
12013022 |
1 |
NOC7H9 |
ABC7D9 |
21.36 |
3.79 |
-9.55 |
0.29 |
0 |
|
|
50482 |
12013023 |
2 |
NOC7H9 |
ABC7D9 |
-55.25 |
4.73 |
-9.41 |
0.2 |
0 |
|
|
50483 |
12013024 |
2 |
NOC8H11 |
ABC8D11 |
-64.98 |
4.48 |
-9.39 |
0.2 |
0 |
|
|
50484 |
12013025 |
1 |
NOC9H13 |
ABC9D13 |
8.8 |
3.64 |
-9.52 |
0.13 |
0 |
|
|
50485 |
12013026 |
1 |
NOH11C12 |
ABC11D12 |
51.83 |
3.47 |
-9.56 |
-0.03 |
0 |
|
|
50486 |
12013027 |
1 |
OH18C21 |
AB18C21 |
43.56 |
1.71 |
-8.81 |
-0.13 |
0 |
|
|
50487 |
12013028 |
1 |
BH3F8C13 |
AB3C8D13 |
-311.01 |
2.26 |
-9.96 |
-2.09 |
0 |
|
|
50488 |
12013029 |
1 |
BF13C18 |
AB13C18 |
-499.97 |
0.32 |
-10.21 |
-2.56 |
0 |
|
|
50489 |
12013030 |
1 |
SnH6F8C14 |
AB6C8D14 |
-292.38 |
4.81 |
-9.65 |
-1.47 |
0 |
|
|
50491 |
12013032 |
1 |
BH6F8C14 |
AB6C8D14 |
-279.96 |
2.34 |
0.0 |
0.0 |
0 |
|
|
50492 |
12013033 |
1 |
NOC9H11 |
ABC9D11 |
-26.92 |
2.53 |
-9.53 |
-0.05 |
0 |
|
|
50493 |
12013034 |
1 |
NOC9H11 |
ABC9D11 |
-26.87 |
2.54 |
-9.55 |
-0.05 |
0 |
|
|
50494 |
12013036 |
1 |
NOC9H11 |
ABC9D11 |
-26.88 |
2.48 |
-9.57 |
-0.05 |
0 |
|
|
50495 |
12013037 |
1 |
NC13H21 |
AB13C21 |
-12.08 |
1.99 |
-8.99 |
0.49 |
0 |
|
|
50496 |
12013038 |
1 |
OS2C4H8 |
AB2C4D8 |
-40.06 |
4.16 |
-8.7 |
-0.6 |
0 |
|
|
50497 |
12013039 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
10.66 |
9.49 |
-8.37 |
-0.22 |
0 |
|
|
50498 |
12013040 |
1 |
SN2O2C16H20 |
AB2C2D16E20 |
-25.77 |
5.61 |
-8.1 |
-0.19 |
0 |
|
|
50499 |
12013041 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
7.91 |
6.97 |
-8.15 |
-0.34 |
0 |
|
|
50500 |
12013042 |
1 |
SN2O2C16H20 |
AB2C2D16E20 |
-27.08 |
7.96 |
-8.09 |
-0.47 |
0 |
|
|
50501 |
12013043 |
1 |
N2O2S2C21H24 |
A2B2C2D21E24 |
-4.65 |
7.87 |
-7.88 |
-0.52 |
0 |
|
|
50502 |
12013044 |
2 |
NOSC8H11 |
ABCD8E11 |
-40.88 |
8.93 |
-8.1 |
-0.57 |
0 |
|
|
50503 |
12013045 |
1 |
SN2O3C21H24 |
AB2C3D21E24 |
-38.03 |
5.35 |
-8.02 |
-0.41 |
0 |
|
|
50504 |
12013046 |
1 |
SN2O3C16H22 |
AB2C3D16E22 |
-74.64 |
8.44 |
-8.04 |
-0.51 |
0 |
|
|
50505 |
12013047 |
1 |
BrNPSO2H27C30 |
ABCDE2F27G30 |
24.42 |
7.04 |
-8.58 |
-0.45 |
0 |
|
|
50506 |
12013048 |
1 |
BrNPSO2C25H25 |
ABCDE2F25G25 |
-8.41 |
7.27 |
-8.65 |
-0.38 |
0 |
|
|
50508 |
12013050 |
1 |
SiC22H29 |
AB22C29 |
15.42 |
1.59 |
0.0 |
0.0 |
0 |
|
|
50509 |
12013051 |
1 |
NO2C9H15 |
AB2C9D15 |
-81.24 |
1.68 |
-10.08 |
0.73 |
0 |
|
|
50510 |
12013052 |
1 |
NO2C13H15 |
AB2C13D15 |
-43.57 |
1.83 |
-9.53 |
0.12 |
0 |
|
|
50511 |
12013055 |
1 |
NO3C11H21 |
AB3C11D21 |
-168.97 |
3.96 |
-9.73 |
0.57 |
0 |
|
|
50512 |
12013056 |
1 |
NO5C15H19 |
AB5C15D19 |
-198.77 |
4.8 |
-9.61 |
-0.28 |
0 |
|
|
50513 |
12013057 |
1 |
NO2S2Cl3C8H8 |
AB2C2D3E8F8 |
4.43 |
6.75 |
-9.31 |
-1.43 |
0 |
|
|
50514 |
12013058 |
1 |
BrNCl2O2S2C8H8 |
ABC2D2E2F8G8 |
12.27 |
6.8 |
-9.25 |
-1.66 |
0 |
|
|
50515 |
12013059 |
1 |
BrNCl2S2O3H4C7 |
ABC2D2E3F4G7 |
-2.04 |
4.27 |
-9.72 |
-1.72 |
0 |