List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
209095 |
80623438 |
1 |
OSF3N3H12C13 |
ABC3D3E12F13 |
-96.8 |
9.07 |
-9.27 |
-0.62 |
0 |
|
|
209096 |
80623490 |
1 |
OSN3C13H17 |
ABC3D13E17 |
37.24 |
6.43 |
-9.31 |
-1.17 |
0 |
|
|
209097 |
80623501 |
1 |
SO2N3C9H17 |
AB2C3D9E17 |
-36.38 |
4.63 |
-9.3 |
-0.9 |
0 |
|
|
209098 |
80623502 |
1 |
SO2N3C6H11 |
AB2C3D6E11 |
-27.8 |
4.98 |
-9.28 |
-0.13 |
0 |
|
|
209099 |
80623503 |
1 |
OSN3C13H25 |
ABC3D13E25 |
-32.92 |
3.76 |
-9.2 |
-0.91 |
0 |
|
|
209100 |
80623504 |
1 |
OSN3C12H23 |
ABC3D12E23 |
-26.3 |
3.95 |
-9.24 |
-0.94 |
0 |
|
|
209101 |
80623692 |
1 |
SO2N3C15H21 |
AB2C3D15E21 |
-15.94 |
6.21 |
-8.42 |
0.03 |
0 |
|
|
209102 |
80624054 |
1 |
SO2N5C10H13 |
AB2C5D10E13 |
8.45 |
4.73 |
-9.52 |
-1.22 |
0 |
|
|
209103 |
80624209 |
1 |
OSCl2N3H7C9 |
ABC2D3E7F9 |
31.74 |
6.61 |
-9.12 |
-0.61 |
0 |
|
|
209104 |
80624345 |
1 |
SN5C9H13 |
AB5C9D13 |
94.03 |
4.97 |
-9.23 |
-0.97 |
0 |
|
|
209105 |
80624430 |
1 |
OSN4C13H22 |
ABC4D13E22 |
-26.01 |
2.14 |
-9.42 |
-1.12 |
0 |
|
|
209106 |
80624524 |
1 |
OSN4C14H26 |
ABC4D14E26 |
-36.49 |
3.1 |
-9.17 |
-1.04 |
0 |
|
|
209107 |
80624525 |
1 |
OSN4C14H24 |
ABC4D14E24 |
-25.93 |
2.81 |
-9.14 |
-0.99 |
0 |
|
|
209108 |
80624526 |
1 |
OSN5C11H13 |
ABC5D11E13 |
36.32 |
3.16 |
-9.35 |
-1.11 |
0 |
|
|
209109 |
80624527 |
1 |
SO2N5C11H13 |
AB2C5D11E13 |
-0.66 |
4.79 |
-8.52 |
-1.26 |
0 |
|
|
209110 |
80626035 |
1 |
ClOSN3C13H14 |
ABCD3E13F14 |
27.3 |
2.78 |
-9.37 |
-1.58 |
0 |
|
|
209111 |
80626325 |
1 |
NSC17H25 |
ABC17D25 |
-11.06 |
3.32 |
-8.45 |
0.66 |
0 |
|
|
209112 |
80626426 |
1 |
SN3C11H19 |
AB3C11D19 |
24.07 |
3.91 |
-8.57 |
0.61 |
0 |
|
|
209113 |
80626427 |
1 |
BrSN3C14H24 |
ABC3D14E24 |
8.85 |
4.91 |
-8.24 |
0.17 |
0 |
|
|
209114 |
80626428 |
1 |
NOSC16H25 |
ABCD16E25 |
-47.37 |
2.88 |
-8.24 |
0.44 |
0 |
|
|
209115 |
80626669 |
1 |
N2S2C17H22 |
A2B2C17D22 |
37.91 |
1.28 |
-8.59 |
-0.65 |
0 |
|
|
209116 |
80626741 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-39.38 |
3.24 |
-8.62 |
-0.1 |
0 |
|
|
209117 |
80626742 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-43.83 |
1.45 |
-8.59 |
0.16 |
0 |
|
|
209118 |
80626920 |
1 |
NSC15H29 |
ABC15D29 |
-50.03 |
2.01 |
-8.34 |
1.0 |
0 |
|
|
209119 |
80626921 |
1 |
BrNOSC15H22 |
ABCDE15F22 |
-32.21 |
5.83 |
-8.47 |
0.24 |
0 |
|
|
209120 |
80627179 |
1 |
NSC13H27 |
ABC13D27 |
-48.06 |
2.57 |
-8.17 |
1.2 |
0 |
|
|
209121 |
80627447 |
1 |
SN2C16H20 |
AB2C16D20 |
24.77 |
2.55 |
-8.59 |
-0.66 |
0 |
|
|
209122 |
80627448 |
1 |
N2S2C11H18 |
A2B2C11D18 |
4.93 |
2.51 |
-8.28 |
0.01 |
0 |
|
|
209123 |
80627655 |
1 |
NSC9H19 |
ABC9D19 |
-34.4 |
2.56 |
-8.64 |
0.69 |
0 |
|
|
209124 |
80627691 |
1 |
SN3C14H23 |
AB3C14D23 |
2.77 |
2.33 |
-8.59 |
0.14 |
0 |
|
|
209125 |
80627692 |
1 |
NSC16H25 |
ABC16D25 |
-19.06 |
3.78 |
-8.26 |
0.35 |
0 |
|
|
209126 |
80627752 |
1 |
NOSC12H25 |
ABCD12E25 |
-82.48 |
1.67 |
-8.53 |
0.66 |
0 |
|
|
209127 |
80627753 |
1 |
BrFNSC15H21 |
ABCDE15F21 |
-46.03 |
5.2 |
-8.63 |
-0.14 |
0 |
|
|
209128 |
80627754 |
1 |
NSC13H25 |
ABC13D25 |
-36.45 |
3.04 |
-8.54 |
0.63 |
0 |
|
|
209129 |
80627755 |
1 |
NS2C12H19 |
AB2C12D19 |
7.46 |
2.56 |
-8.47 |
-0.09 |
0 |
|
|
209130 |
80627883 |
1 |
NSCl2C12H15 |
ABC2D12E15 |
-9.64 |
3.49 |
-8.65 |
-0.44 |
0 |
|
|
209131 |
80627994 |
1 |
ClN2C14H21 |
AB2C14D21 |
-6.67 |
3.82 |
-8.1 |
-0.05 |
0 |
|
|
209132 |
80628309 |
1 |
ClN2O4H9C12 |
AB2C4D9E12 |
-33.52 |
4.0 |
-9.77 |
-1.71 |
0 |
|
|
209133 |
80628310 |
1 |
FN2O2H11C14 |
AB2C2D11E14 |
-46.24 |
5.6 |
-9.58 |
-1.05 |
0 |
|
|
209134 |
80628426 |
1 |
ClN3C16H16 |
AB3C16D16 |
66.59 |
5.76 |
-8.86 |
-0.67 |
0 |
|
|
209135 |
80628575 |
1 |
ClN2O3H13C14 |
AB2C3D13E14 |
-14.05 |
7.25 |
-9.62 |
-1.26 |
0 |
|
|
209136 |
80628586 |
2 |
N2C7H12 |
A2B7C12 |
17.73 |
3.22 |
-8.28 |
-0.04 |
0 |
|
|
209137 |
80629083 |
1 |
N3C14H23 |
A3B14C23 |
7.74 |
0.77 |
-8.32 |
0.2 |
0 |
|
|
209138 |
80629167 |
1 |
ClNOF2H10C13 |
ABCD2E10F13 |
-85.57 |
1.01 |
-9.39 |
-0.63 |
0 |
|
|
209139 |
80629714 |
1 |
ON3C16H27 |
AB3C16D27 |
-18.7 |
2.45 |
-8.51 |
0.02 |
0 |
|
|
209140 |
80629829 |
1 |
N3C18H31 |
A3B18C31 |
-15.12 |
2.94 |
-8.12 |
0.24 |
0 |
|
|
209141 |
80629973 |
1 |
ON3C15H25 |
AB3C15D25 |
-14.42 |
3.64 |
-8.52 |
0.0 |
0 |
|
|
209142 |
80629974 |
1 |
ON3C15H25 |
AB3C15D25 |
-15.7 |
4.78 |
-8.32 |
0.12 |
0 |
|
|
209143 |
80629975 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-64.1 |
3.11 |
-8.77 |
0.0 |
0 |
|
|
209144 |
80629976 |
1 |
ON3C16H27 |
AB3C16D27 |
-37.64 |
4.68 |
-8.52 |
0.01 |
0 |