List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
26698 |
794671 |
1 |
N4O4C15H16 |
A4B4C15D16 |
-42.97 |
8.93 |
-9.12 |
-0.94 |
0 |
|
|
26699 |
794673 |
1 |
N2O3H14C15 |
A2B3C14D15 |
-54.97 |
4.27 |
-8.47 |
-0.83 |
0 |
|
|
26700 |
794674 |
1 |
N2O5H16C18 |
A2B5C16D18 |
-26.54 |
7.32 |
-8.88 |
-1.29 |
0 |
|
|
26701 |
794677 |
1 |
ClO4H13C17 |
AB4C13D17 |
-98.68 |
4.0 |
-8.55 |
-1.38 |
0 |
|
|
26702 |
794678 |
1 |
N2O3C17H18 |
A2B3C17D18 |
-42.04 |
5.1 |
-8.51 |
-0.35 |
0 |
|
|
26703 |
794679 |
1 |
SN2O4H14C16 |
AB2C4D14E16 |
-35.64 |
7.77 |
-9.51 |
-1.36 |
0 |
|
|
26704 |
794680 |
1 |
N2O2H14C15 |
A2B2C14D15 |
-12.53 |
3.81 |
-9.09 |
-0.54 |
0 |
|
|
26705 |
794681 |
1 |
N3O4H15C18 |
A3B4C15D18 |
-13.42 |
4.54 |
-9.1 |
-1.87 |
0 |
|
|
26706 |
794682 |
1 |
NO2H15C18 |
AB2C15D18 |
6.65 |
3.14 |
-8.28 |
-0.76 |
0 |
|
|
26707 |
794684 |
1 |
SN4H16C17 |
AB4C16D17 |
103.42 |
6.96 |
-8.42 |
-0.83 |
0 |
|
|
26708 |
794709 |
1 |
BrNO2C17H18 |
ABC2D17E18 |
-27.56 |
6.35 |
-8.58 |
-0.42 |
0 |
|
|
26709 |
794715 |
1 |
S2N3H9C10 |
A2B3C9D10 |
90.11 |
2.26 |
-8.11 |
-0.81 |
0 |
|
|
26710 |
794719 |
1 |
NSO3C14H15 |
ABC3D14E15 |
-100.6 |
3.08 |
-9.15 |
-0.49 |
0 |
|
|
26711 |
794720 |
2 |
NOH6C8 |
ABC6D8 |
46.21 |
0.43 |
-8.67 |
-0.96 |
0 |
|
|
26712 |
794727 |
1 |
ClN2H15C21 |
AB2C15D21 |
94.04 |
3.93 |
-8.56 |
-0.75 |
0 |
|
|
26713 |
794733 |
1 |
ClO2N3H14C16 |
AB2C3D14E16 |
-20.28 |
3.11 |
-8.92 |
-0.62 |
0 |
|
|
26714 |
794734 |
1 |
ClO2N3H14C16 |
AB2C3D14E16 |
-20.25 |
3.13 |
-8.89 |
-0.6 |
0 |
|
|
26715 |
794737 |
1 |
BrN2O3H11C14 |
AB2C3D11E14 |
-39.51 |
1.06 |
-8.79 |
-1.0 |
0 |
|
|
26716 |
794738 |
1 |
ON2H14C15 |
AB2C14D15 |
20.42 |
4.8 |
-9.32 |
-0.73 |
0 |
|
|
26717 |
794742 |
1 |
O2N4C19H20 |
A2B4C19D20 |
8.89 |
7.19 |
-8.29 |
-0.7 |
0 |
|
|
26718 |
794750 |
1 |
SN2O4C11H12 |
AB2C4D11E12 |
-68.23 |
7.31 |
-9.59 |
-1.25 |
0 |
|
|
26719 |
794756 |
3 |
OH4C5 |
AB4C5 |
-78.16 |
3.76 |
-8.87 |
-0.92 |
0 |
|
|
26720 |
794764 |
1 |
O2F3N4H11C16 |
A2B3C4D11E16 |
-126.77 |
0.99 |
-8.98 |
-1.43 |
0 |
|
|
26721 |
794772 |
1 |
OSN2Cl3C10H13 |
ABC2D3E10F13 |
-47.85 |
4.14 |
-9.61 |
-1.01 |
0 |
|
|
26722 |
794781 |
1 |
O2N3C13H13 |
A2B3C13D13 |
-32.13 |
5.5 |
-9.1 |
-0.98 |
0 |
|
|
26723 |
794782 |
1 |
O2N3C15H17 |
A2B3C15D17 |
-34.47 |
6.94 |
-9.15 |
-0.94 |
0 |
|
|
26724 |
794783 |
1 |
NF2O4H9C14 |
AB2C4D9E14 |
-136.29 |
8.75 |
-10.06 |
-1.67 |
0 |
|
|
26725 |
794789 |
1 |
NOSCl2H11C12 |
ABCD2E11F12 |
-34.35 |
3.15 |
-9.08 |
-1.37 |
0 |
|
|
26726 |
794794 |
1 |
ON2H14C18 |
AB2C14D18 |
46.89 |
4.82 |
-9.12 |
-1.1 |
0 |
|
|
26727 |
794805 |
1 |
ON2H12C14 |
AB2C12D14 |
29.21 |
3.1 |
-9.36 |
-0.65 |
0 |
|
|
26728 |
794873 |
1 |
BrSN2O4H9C10 |
ABC2D4E9F10 |
-55.29 |
5.31 |
-9.72 |
-1.61 |
0 |
|
|
26729 |
794924 |
1 |
OSCl2N4H10C11 |
ABC2D4E10F11 |
31.21 |
4.24 |
-8.74 |
-1.61 |
0 |
|
|
26730 |
794936 |
1 |
ON3C15H15 |
AB3C15D15 |
26.02 |
2.94 |
-8.83 |
-0.52 |
0 |
|
|
26731 |
794944 |
1 |
NOF2C11H13 |
ABC2D11E13 |
-125.11 |
4.72 |
-9.5 |
-0.67 |
0 |
|
|
26732 |
795024 |
1 |
NSO3C17H19 |
ABC3D17E19 |
-103.53 |
4.22 |
-9.01 |
-0.54 |
0 |
|
|
26733 |
795066 |
1 |
N4O5C9H16 |
A4B5C9D16 |
-216.12 |
1.49 |
-10.06 |
-0.24 |
0 |
|
|
26734 |
795416 |
1 |
N2O2C19H20 |
A2B2C19D20 |
-14.8 |
1.89 |
-9.26 |
-0.6 |
0 |
|
|
26735 |
795458 |
1 |
N2O5C13H16 |
A2B5C13D16 |
-124.63 |
6.41 |
-10.4 |
-1.63 |
0 |
|
|
26736 |
795880 |
1 |
ClNO2F3H13C16 |
ABC2D3E13F16 |
-212.82 |
8.87 |
-9.18 |
-0.86 |
0 |
|
|
26737 |
796053 |
1 |
NO2C16H17 |
AB2C16D17 |
-44.92 |
5.25 |
-8.9 |
0.02 |
0 |
|
|
26738 |
796319 |
1 |
SN3C18H21 |
AB3C18D21 |
57.89 |
4.85 |
-8.3 |
-0.55 |
0 |
|
|
26739 |
796406 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-39.0 |
7.97 |
-9.02 |
-0.26 |
0 |
|
|
26740 |
796424 |
1 |
FIO2N3H7C10 |
ABC2D3E7F10 |
-53.3 |
5.69 |
-9.16 |
-0.97 |
0 |
|
|
26741 |
796467 |
1 |
ClN2O2C18H25 |
AB2C2D18E25 |
-77.31 |
3.03 |
-8.73 |
-0.37 |
0 |
|
|
26742 |
796904 |
1 |
O3H8C9 |
A3B8C9 |
-78.09 |
5.39 |
-9.42 |
-1.06 |
0 |
|
|
26743 |
797315 |
1 |
OSN2H18C19 |
ABC2D18E19 |
37.75 |
6.82 |
-8.34 |
-0.59 |
0 |
|
|
26744 |
797345 |
1 |
ON3C18H19 |
AB3C18D19 |
31.52 |
3.03 |
-8.38 |
-0.5 |
0 |
|
|
26745 |
797438 |
1 |
ClNO3C18H20 |
ABC3D18E20 |
-103.19 |
5.73 |
-8.46 |
-0.23 |
0 |
|
|
26746 |
797801 |
1 |
N3O3H15C20 |
A3B3C15D20 |
-11.33 |
3.47 |
-9.03 |
-1.51 |
0 |
|
|
26747 |
798021 |
1 |
N2S3H8C9 |
A2B3C8D9 |
82.73 |
4.52 |
-8.72 |
-1.18 |
0 |
|
|
26748 |
798022 |
1 |
SN4C9H18 |
AB4C9D18 |
25.97 |
6.84 |
-8.51 |
-0.25 |
0 |
|
|
26749 |
798023 |
1 |
N3H11C15 |
A3B11C15 |
132.8 |
8.19 |
-8.9 |
-1.31 |
0 |
|
|
26750 |
798125 |
1 |
NOCl2H17C18 |
ABC2D17E18 |
-17.1 |
5.71 |
-8.89 |
-0.98 |
0 |
|
|
26751 |
798134 |
1 |
ClFN2S2H12C15 |
ABC2D2E12F15 |
9.28 |
4.31 |
-8.68 |
-0.9 |
0 |
|
|
26752 |
798136 |
1 |
FNO3C14H18 |
ABC3D14E18 |
-173.48 |
4.3 |
-10.14 |
-0.57 |
0 |
|
|
26753 |
798209 |
1 |
NO2C16H27 |
AB2C16D27 |
-99.06 |
2.18 |
-8.66 |
0.29 |
0 |
|
|
26754 |
798219 |
1 |
SN2O4C17H20 |
AB2C4D17E20 |
-112.78 |
5.53 |
-8.64 |
-0.59 |
0 |
|
|
26755 |
798220 |
1 |
ON3C19H19 |
AB3C19D19 |
4.3 |
4.7 |
-8.17 |
-0.45 |
0 |
|
|
26756 |
798223 |
1 |
NSO3H15C16 |
ABC3D15E16 |
-66.2 |
1.01 |
-8.33 |
-0.63 |
0 |
|
|
26757 |
798225 |
1 |
NO3C19H23 |
AB3C19D23 |
-96.53 |
3.89 |
-9.01 |
-0.2 |
0 |
|
|
26758 |
798226 |
1 |
ON2C19H20 |
AB2C19D20 |
9.74 |
5.21 |
-8.17 |
-0.32 |
0 |
|
|
26759 |
798228 |
1 |
OSN2C14H16 |
ABC2D14E16 |
0.93 |
3.19 |
-8.9 |
-0.35 |
0 |
|
|
26760 |
798229 |
1 |
FNO3H14C15 |
ABC3D14E15 |
-70.51 |
1.74 |
-8.45 |
-0.43 |
0 |
|
|
26761 |
798230 |
1 |
FN2H15C17 |
AB2C15D17 |
8.26 |
2.73 |
-8.42 |
-0.61 |
0 |
|
|
26762 |
798231 |
1 |
ON2H18C19 |
AB2C18D19 |
12.0 |
2.14 |
-8.6 |
-0.88 |
0 |
|
|
26763 |
798245 |
1 |
FNOH16C17 |
ABCD16E17 |
-51.78 |
2.97 |
-9.42 |
-0.2 |
0 |
|
|
26764 |
798247 |
1 |
ON4H8C12 |
AB4C8D12 |
105.96 |
2.32 |
-9.97 |
-1.39 |
0 |
|
|
26765 |
798250 |
1 |
NO3C19H21 |
AB3C19D21 |
-101.22 |
3.64 |
-9.35 |
-0.49 |
0 |
|
|
26766 |
798256 |
1 |
N2O2C19H20 |
A2B2C19D20 |
-19.2 |
4.97 |
-7.98 |
-0.33 |
0 |
|
|
26767 |
798259 |
1 |
NO4C19H19 |
AB4C19D19 |
-116.24 |
5.49 |
-8.77 |
-0.59 |
0 |
|
|
26768 |
798260 |
1 |
NO4C19H19 |
AB4C19D19 |
-116.04 |
7.45 |
-8.8 |
-0.58 |
0 |
|
|
26769 |
798261 |
2 |
NOC8H9 |
ABC8D9 |
-37.07 |
6.26 |
-9.15 |
-0.41 |
0 |
|
|
26770 |
798266 |
1 |
N2O6H14C15 |
A2B6C14D15 |
-145.32 |
2.5 |
-10.78 |
-2.06 |
0 |
|
|
26771 |
798269 |
1 |
FON2H15C17 |
ABC2D15E17 |
-19.72 |
1.13 |
-8.24 |
-0.66 |
0 |
|
|
26772 |
798274 |
2 |
NOC9H9 |
ABC9D9 |
-15.48 |
1.56 |
-8.21 |
-0.6 |
0 |