List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
285950 |
104140736 |
1 |
ON4C15H16 |
AB4C15D16 |
50.62 |
3.57 |
-9.17 |
-1.05 |
0 |
|
|
285951 |
104140872 |
1 |
NO3C17H21 |
AB3C17D21 |
-90.2 |
2.84 |
-8.63 |
-0.1 |
0 |
|
|
285952 |
104140937 |
1 |
FNO2C15H16 |
ABC2D15E16 |
-90.87 |
1.49 |
-9.29 |
-0.3 |
0 |
|
|
285953 |
104140943 |
1 |
BrNO2C15H16 |
ABC2D15E16 |
-41.92 |
2.65 |
-9.36 |
-0.4 |
0 |
|
|
285954 |
104141052 |
1 |
NO3C17H21 |
AB3C17D21 |
-92.5 |
2.18 |
-8.95 |
-0.09 |
0 |
|
|
285955 |
104141063 |
1 |
NO2C13H19 |
AB2C13D19 |
-68.25 |
1.48 |
-9.23 |
-0.05 |
0 |
|
|
285956 |
104141250 |
1 |
N2O2C13H22 |
A2B2C13D22 |
-79.02 |
2.73 |
-8.83 |
-0.02 |
0 |
|
|
285957 |
104141276 |
1 |
NO2C17H21 |
AB2C17D21 |
-59.84 |
1.53 |
-9.23 |
-0.05 |
0 |
|
|
285958 |
104141837 |
1 |
BrClN2C17H20 |
ABC2D17E20 |
26.3 |
1.55 |
-8.67 |
-0.21 |
0 |
|
|
285959 |
104141976 |
1 |
ClN2O2C16H27 |
AB2C2D16E27 |
-92.68 |
2.76 |
-8.57 |
-0.07 |
0 |
|
|
285960 |
104142006 |
1 |
ClN2O2C16H27 |
AB2C2D16E27 |
-96.27 |
2.87 |
-8.58 |
-0.13 |
0 |
|
|
285961 |
104142020 |
1 |
ClON2C17H27 |
ABC2D17E27 |
-36.53 |
1.37 |
-8.46 |
0.03 |
0 |
|
|
285962 |
104142060 |
1 |
ClON2C15H21 |
ABC2D15E21 |
-39.1 |
2.04 |
-8.61 |
-0.08 |
0 |
|
|
285963 |
104142263 |
1 |
ClN3C15H26 |
AB3C15D26 |
-7.37 |
1.01 |
-8.42 |
0.04 |
0 |
|
|
285964 |
104142264 |
1 |
ClN3C16H28 |
AB3C16D28 |
-11.07 |
2.51 |
-8.25 |
0.02 |
0 |
|
|
285965 |
104142480 |
1 |
ClN3C12H14 |
AB3C12D14 |
39.45 |
5.43 |
-9.4 |
-0.89 |
0 |
|
|
285966 |
104142481 |
1 |
ClN3C17H18 |
AB3C17D18 |
43.96 |
5.0 |
-8.66 |
-0.76 |
0 |
|
|
285967 |
104142493 |
1 |
ClN4C15H15 |
AB4C15D15 |
84.2 |
3.72 |
-9.19 |
-1.09 |
0 |
|
|
285968 |
104142555 |
1 |
Cl2N3C14H17 |
A2B3C14D17 |
26.8 |
2.21 |
-9.01 |
-0.83 |
0 |
|
|
285969 |
104142558 |
1 |
ClN4C16H23 |
AB4C16D23 |
23.96 |
2.27 |
-9.3 |
-0.7 |
0 |
|
|
285970 |
104142564 |
1 |
ClN3C16H22 |
AB3C16D22 |
21.13 |
1.6 |
-8.99 |
-0.55 |
0 |
|
|
285971 |
104142620 |
1 |
NOCl2C15H15 |
ABC2D15E15 |
-23.68 |
1.6 |
-9.35 |
-0.3 |
0 |
|
|
285972 |
104142642 |
1 |
ClNO2C13H20 |
ABC2D13E20 |
-96.17 |
2.55 |
-9.27 |
-0.33 |
0 |
|
|
285973 |
104142652 |
1 |
ClNOF4C11H12 |
ABCD4E11F12 |
-242.56 |
3.8 |
-9.74 |
-0.6 |
0 |
|
|
285974 |
104142806 |
1 |
NOCl2C16H17 |
ABC2D16E17 |
-24.89 |
3.22 |
-9.22 |
-0.52 |
0 |
|
|
285975 |
104143084 |
1 |
NOCl2C17H19 |
ABC2D17E19 |
-33.6 |
3.43 |
-9.13 |
-0.5 |
0 |
|
|
285976 |
104143087 |
1 |
ClNOC14H22 |
ABCD14E22 |
-69.85 |
2.24 |
-9.16 |
-0.26 |
0 |
|
|
285977 |
104143211 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-87.86 |
1.51 |
-8.77 |
-0.05 |
0 |
|
|
285978 |
104143255 |
1 |
ON4C14H22 |
AB4C14D22 |
-25.44 |
4.82 |
-8.72 |
-0.13 |
0 |
|
|
285979 |
104143387 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-38.06 |
4.11 |
-8.94 |
-0.35 |
0 |
|
|
285980 |
104143388 |
1 |
OCl2N3C15H15 |
AB2C3D15E15 |
-23.25 |
2.09 |
-9.05 |
-0.52 |
0 |
|
|
285981 |
104143414 |
1 |
BrON3C16H18 |
ABC3D16E18 |
-3.08 |
4.15 |
-8.83 |
-0.55 |
0 |
|
|
285982 |
104143458 |
1 |
ClON3C15H16 |
ABC3D15E16 |
-11.64 |
3.73 |
-8.92 |
-0.35 |
0 |
|
|
285983 |
104143472 |
1 |
ON3C13H21 |
AB3C13D21 |
-49.34 |
4.41 |
-8.9 |
-0.21 |
0 |
|
|
285984 |
104143538 |
1 |
ON5C15H19 |
AB5C15D19 |
16.47 |
2.3 |
-8.72 |
-0.6 |
0 |
|
|
285985 |
104143572 |
1 |
ON4C15H22 |
AB4C15D22 |
-11.4 |
6.21 |
-8.89 |
-0.26 |
0 |
|
|
285986 |
104143951 |
1 |
ON3C15H25 |
AB3C15D25 |
-55.4 |
2.08 |
-8.75 |
-0.09 |
0 |
|
|
285987 |
104144064 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-77.84 |
2.07 |
-9.07 |
-0.24 |
0 |
|
|
285988 |
104144179 |
1 |
ON3C15H25 |
AB3C15D25 |
-50.73 |
4.7 |
-8.46 |
0.14 |
0 |
|
|
285989 |
104144275 |
1 |
FON3C16H18 |
ABC3D16E18 |
-56.86 |
3.93 |
-8.99 |
-0.53 |
0 |
|
|
285990 |
104144278 |
1 |
ClON3C14H14 |
ABC3D14E14 |
-7.88 |
2.15 |
-9.04 |
-0.6 |
0 |
|
|
285991 |
104144280 |
1 |
ClON3C16H18 |
ABC3D16E18 |
-12.95 |
1.34 |
-8.9 |
-0.57 |
0 |
|
|
285992 |
104144282 |
1 |
ClON3C15H16 |
ABC3D15E16 |
-12.39 |
1.37 |
-9.08 |
-0.61 |
0 |
|
|
285993 |
104144352 |
1 |
FON3C16H18 |
ABC3D16E18 |
-55.63 |
3.56 |
-8.86 |
-0.48 |
0 |
|
|
285994 |
104144718 |
1 |
ON3C17H29 |
AB3C17D29 |
-60.78 |
3.64 |
-8.56 |
0.1 |
0 |
|
|
285995 |
104144725 |
1 |
ON3C15H25 |
AB3C15D25 |
-54.14 |
5.16 |
-8.84 |
-0.01 |
0 |
|
|
285996 |
104144727 |
1 |
ON3C13H21 |
AB3C13D21 |
-36.92 |
2.97 |
-8.74 |
0.0 |
0 |
|
|
285997 |
104144803 |
1 |
ON3C16H27 |
AB3C16D27 |
-53.86 |
5.55 |
-8.68 |
0.04 |
0 |
|
|
285998 |
104144807 |
1 |
ON3C16H27 |
AB3C16D27 |
-54.79 |
3.57 |
-8.72 |
0.02 |
0 |
|
|
285999 |
104144813 |
1 |
ON3C15H25 |
AB3C15D25 |
-54.38 |
5.37 |
-8.88 |
-0.05 |
0 |