List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
199595 |
79268788 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-80.28 |
4.21 |
-8.04 |
0.52 |
0 |
|
|
199596 |
79268789 |
1 |
NO3C14H27 |
AB3C14D27 |
-169.61 |
3.3 |
-8.97 |
0.46 |
0 |
|
|
199597 |
79268790 |
1 |
BrN2O2C15H19 |
AB2C2D15E19 |
-62.4 |
6.84 |
-8.63 |
-0.25 |
0 |
|
|
199598 |
79268791 |
5 |
NC2H3 |
AB2C3 |
75.7 |
9.0 |
-9.39 |
-1.23 |
0 |
|
|
199599 |
79268792 |
1 |
NSO4C12H23 |
ABC4D12E23 |
-202.34 |
2.74 |
-9.24 |
0.7 |
0 |
|
|
199600 |
79268793 |
1 |
NO2C15H29 |
AB2C15D29 |
-131.91 |
4.52 |
-8.87 |
0.6 |
0 |
|
|
199601 |
79268794 |
1 |
NO2C17H27 |
AB2C17D27 |
-110.03 |
3.89 |
-8.82 |
0.25 |
0 |
|
|
199602 |
79268795 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-95.05 |
3.79 |
-9.09 |
-0.1 |
0 |
|
|
199603 |
79269031 |
1 |
N2O3C14H26 |
A2B3C14D26 |
-160.57 |
3.79 |
-9.26 |
0.59 |
0 |
|
|
199604 |
79269101 |
1 |
NO2C10H21 |
AB2C10D21 |
-123.4 |
4.2 |
-8.95 |
0.55 |
0 |
|
|
199605 |
79269102 |
1 |
NO2C15H31 |
AB2C15D31 |
-146.89 |
4.26 |
-8.98 |
0.55 |
0 |
|
|
199606 |
79269475 |
1 |
SN2O5C11H22 |
AB2C5D11E22 |
-241.39 |
4.0 |
-9.79 |
0.48 |
0 |
|
|
199607 |
79269476 |
1 |
NO4C10H21 |
AB4C10D21 |
-197.98 |
4.77 |
-9.7 |
0.78 |
0 |
|
|
199608 |
79269531 |
1 |
NSO4C11H23 |
ABC4D11E23 |
-216.97 |
5.08 |
-10.15 |
0.01 |
0 |
|
|
199609 |
79270016 |
1 |
N2O2C11H18 |
A2B2C11D18 |
-41.78 |
3.36 |
-9.38 |
0.77 |
0 |
|
|
199610 |
79270017 |
2 |
NOC7H9 |
ABC7D9 |
-19.69 |
3.04 |
-8.89 |
0.25 |
0 |
|
|
199611 |
79270769 |
1 |
N2O4C15H26 |
A2B4C15D26 |
-185.45 |
7.25 |
-9.38 |
0.01 |
0 |
|
|
199612 |
79270770 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-48.3 |
1.87 |
-7.97 |
0.32 |
0 |
|
|
199613 |
79270771 |
1 |
ON2C18H24 |
AB2C18D24 |
-1.57 |
1.81 |
-8.12 |
0.27 |
0 |
|
|
199614 |
79271043 |
1 |
ON2C13H14 |
AB2C13D14 |
32.17 |
2.7 |
-9.21 |
0.11 |
0 |
|
|
199615 |
79271145 |
2 |
NO2C7H13 |
AB2C7D13 |
-195.96 |
6.04 |
-9.66 |
0.18 |
0 |
|
|
199616 |
79271146 |
1 |
N2O5C10H20 |
A2B5C10D20 |
-226.98 |
6.77 |
-9.67 |
0.01 |
0 |
|
|
199617 |
79271147 |
1 |
N2O4C11H20 |
A2B4C11D20 |
-184.73 |
7.03 |
-9.85 |
0.49 |
0 |
|
|
199618 |
79271691 |
1 |
FN2O2H15C16 |
AB2C2D15E16 |
-77.06 |
4.41 |
-8.26 |
-0.32 |
0 |
|
|
199619 |
79271900 |
1 |
N3O4C12H17 |
A3B4C12D17 |
-139.06 |
5.62 |
-10.06 |
-0.22 |
0 |
|
|
199620 |
79271901 |
2 |
NO2C5H9 |
AB2C5D9 |
-156.2 |
6.51 |
-9.75 |
0.05 |
0 |
|
|
199621 |
79271902 |
1 |
N2O4C11H22 |
A2B4C11D22 |
-196.42 |
6.64 |
-9.54 |
0.2 |
0 |
|
|
199622 |
79271995 |
1 |
ON3C5H9 |
AB3C5D9 |
32.59 |
2.8 |
-9.75 |
0.58 |
0 |
|
|
199623 |
79271996 |
1 |
ON2C11H18 |
AB2C11D18 |
11.19 |
4.64 |
-9.29 |
0.9 |
0 |
|
|
199624 |
79271997 |
1 |
ON3C17H23 |
AB3C17D23 |
19.39 |
2.55 |
-8.93 |
0.31 |
0 |
|
|
199625 |
79272193 |
1 |
N3O4C14H25 |
A3B4C14D25 |
-157.58 |
3.89 |
-8.93 |
0.23 |
0 |
|
|
199626 |
79272610 |
1 |
SN3H15C16 |
AB3C15D16 |
65.55 |
3.14 |
-8.55 |
-0.98 |
0 |
|
|
199627 |
79272851 |
2 |
NO2C6H6 |
AB2C6D6 |
-22.18 |
4.73 |
-10.28 |
-1.71 |
0 |
|
|
199628 |
79272852 |
1 |
N2O3C10H16 |
A2B3C10D16 |
-107.5 |
8.08 |
-9.93 |
-0.04 |
0 |
|
|
199629 |
79273889 |
2 |
NO2C6H6 |
AB2C6D6 |
-21.79 |
7.18 |
-10.21 |
-1.7 |
0 |
|
|
199630 |
79274155 |
1 |
ClO2N3H14C15 |
AB2C3D14E15 |
2.51 |
2.87 |
-8.75 |
-0.75 |
0 |
|
|
199631 |
79274197 |
1 |
ClSO2N4C13H19 |
ABC2D4E13F19 |
-59.75 |
3.59 |
-9.27 |
-0.51 |
0 |
|
|
199632 |
79274227 |
1 |
BrNO2C12H12 |
ABC2D12E12 |
-15.76 |
5.52 |
-9.93 |
-0.57 |
0 |
|
|
199633 |
79274228 |
1 |
FN2O3C13H13 |
AB2C3D13E13 |
-102.66 |
5.75 |
-9.4 |
-0.61 |
0 |
|
|
199634 |
79274229 |
1 |
N2O3C13H22 |
A2B3C13D22 |
-101.78 |
9.9 |
-9.73 |
0.53 |
0 |
|
|
199635 |
79274773 |
1 |
NSO4C12H13 |
ABC4D12E13 |
-99.83 |
7.6 |
-9.97 |
-0.69 |
0 |
|
|
199636 |
79274810 |
1 |
O2N3C10H13 |
A2B3C10D13 |
0.42 |
8.24 |
-9.46 |
0.06 |
0 |
|
|
199637 |
79274934 |
1 |
ClN4C16H25 |
AB4C16D25 |
17.43 |
7.4 |
-8.88 |
-0.64 |
0 |
|
|
199638 |
79275017 |
2 |
N2C8H11 |
A2B8C11 |
42.58 |
2.62 |
-8.72 |
-0.31 |
0 |
|
|
199639 |
79275075 |
1 |
ClN4C16H19 |
AB4C16D19 |
76.09 |
5.01 |
-8.77 |
-0.08 |
0 |
|
|
199640 |
79275162 |
1 |
N2O3C11H16 |
A2B3C11D16 |
-94.97 |
2.08 |
-9.74 |
-0.05 |
0 |
|
|
199641 |
79275681 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-55.79 |
4.04 |
-9.69 |
-0.96 |
0 |
|
|
199642 |
79275718 |
1 |
Cl2N3H15C16 |
A2B3C15D16 |
41.2 |
1.92 |
-9.14 |
-0.59 |
0 |
|
|
199643 |
79275719 |
1 |
N2O3C12H22 |
A2B3C12D22 |
-135.3 |
7.28 |
-9.57 |
0.22 |
0 |
|
|
199644 |
79276174 |
1 |
N3O4C12H19 |
A3B4C12D19 |
-160.26 |
6.41 |
-9.53 |
-0.15 |
0 |