List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
259000 |
103157890 |
1 |
O2N4C13H18 |
A2B4C13D18 |
4.71 |
2.93 |
-9.49 |
-0.47 |
0 |
|
|
259001 |
103157894 |
1 |
ClFO2N3C13H15 |
ABC2D3E13F15 |
-57.61 |
2.65 |
-9.64 |
-0.47 |
0 |
|
|
259002 |
103157900 |
1 |
N3O4C7H11 |
A3B4C7D11 |
-97.15 |
7.04 |
-10.11 |
-1.14 |
0 |
|
|
259003 |
103157903 |
1 |
N3O3C11H19 |
A3B3C11D19 |
-76.1 |
2.38 |
-9.59 |
-0.31 |
0 |
|
|
259004 |
103157905 |
1 |
NO2C12H25 |
AB2C12D25 |
-137.15 |
3.07 |
-9.02 |
2.45 |
0 |
|
|
259005 |
103157908 |
3 |
NOC4H7 |
ABC4D7 |
-85.04 |
2.9 |
-9.67 |
-0.23 |
0 |
|
|
259006 |
103157925 |
1 |
N3O3C10H19 |
A3B3C10D19 |
-76.16 |
1.64 |
-9.58 |
-0.38 |
0 |
|
|
259007 |
103157926 |
1 |
BrFNOC14H19 |
ABCDE14F19 |
-93.08 |
3.76 |
-8.73 |
-0.21 |
0 |
|
|
259008 |
103157931 |
1 |
ON2C17H32 |
AB2C17D32 |
-89.87 |
0.91 |
-8.56 |
2.55 |
0 |
|
|
259009 |
103157936 |
1 |
BrNOF3C15H19 |
ABCD3E15F19 |
-207.55 |
3.93 |
-9.07 |
-0.8 |
0 |
|
|
259010 |
103157940 |
1 |
BrNO2C15H22 |
ABC2D15E22 |
-82.03 |
4.81 |
-8.18 |
-0.17 |
0 |
|
|
259011 |
103157941 |
1 |
N3O3C12H23 |
A3B3C12D23 |
-90.7 |
2.2 |
-9.5 |
-0.42 |
0 |
|
|
259012 |
103157942 |
1 |
NOC13H25 |
ABC13D25 |
-66.21 |
2.03 |
-8.95 |
2.52 |
0 |
|
|
259013 |
103157944 |
1 |
NOC16H31 |
ABC16D31 |
-99.21 |
1.54 |
-8.93 |
2.56 |
0 |
|
|
259014 |
103157948 |
1 |
NOC14H25 |
ABC14D25 |
-71.65 |
1.86 |
-8.92 |
1.44 |
0 |
|
|
259015 |
103157949 |
1 |
N3O3C13H23 |
A3B3C13D23 |
-85.79 |
2.08 |
-9.62 |
-0.32 |
0 |
|
|
259016 |
103157970 |
1 |
NO3C11H23 |
AB3C11D23 |
-170.47 |
4.4 |
-9.4 |
2.21 |
0 |
|
|
259017 |
103157983 |
1 |
O3N4C10H18 |
A3B4C10D18 |
-57.6 |
1.37 |
-9.14 |
-0.14 |
0 |
|
|
259018 |
103157986 |
2 |
NOC8H15 |
ABC8D15 |
-113.27 |
2.95 |
-8.7 |
1.99 |
0 |
|
|
259019 |
103157988 |
1 |
BrO2N3C14H18 |
AB2C3D14E18 |
-14.49 |
2.6 |
-9.39 |
-0.86 |
0 |
|
|
259020 |
103157995 |
1 |
O3N4C7H12 |
A3B4C7D12 |
-56.89 |
5.31 |
-9.84 |
-0.8 |
0 |
|
|
259021 |
103158003 |
1 |
N2O2C15H28 |
A2B2C15D28 |
-108.02 |
4.6 |
-9.2 |
0.95 |
0 |
|
|
259022 |
103158006 |
1 |
NOC17H27 |
ABC17D27 |
-61.58 |
0.86 |
-9.16 |
0.39 |
0 |
|
|
259023 |
103158007 |
1 |
ON3C12H21 |
AB3C12D21 |
-27.37 |
2.06 |
-8.23 |
0.86 |
0 |
|
|
259024 |
103158010 |
1 |
NOC15H29 |
ABC15D29 |
-97.6 |
1.61 |
-8.96 |
2.5 |
0 |
|
|
259025 |
103158023 |
1 |
BrN2O2C11H13 |
AB2C2D11E13 |
-32.73 |
2.92 |
-9.52 |
-0.85 |
0 |
|
|
259026 |
103158025 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-54.24 |
2.19 |
-9.08 |
-0.34 |
0 |
|
|
259027 |
103158028 |
1 |
N2O2F3C12H13 |
A2B2C3D12E13 |
-197.73 |
4.71 |
-9.7 |
-1.0 |
0 |
|
|
259028 |
103158029 |
1 |
SN2O4C12H16 |
AB2C4D12E16 |
-118.71 |
6.76 |
-9.65 |
-0.84 |
0 |
|
|
259029 |
103158030 |
1 |
NOSC15H25 |
ABCD15E25 |
-57.75 |
1.37 |
-8.87 |
0.0 |
0 |
|
|
259030 |
103158034 |
1 |
FNOC17H26 |
ABCD17E26 |
-113.62 |
1.32 |
-9.26 |
0.18 |
0 |
|
|
259031 |
103158035 |
1 |
BrN2O2C11H13 |
AB2C2D11E13 |
-31.24 |
0.82 |
-9.54 |
-0.84 |
0 |
|
|
259032 |
103158036 |
1 |
NO2C13H27 |
AB2C13D27 |
-138.76 |
3.29 |
-9.22 |
2.42 |
0 |
|
|
259033 |
103158050 |
1 |
NOSC13H25 |
ABCD13E25 |
-85.45 |
2.68 |
-8.56 |
0.64 |
0 |
|
|
259034 |
103158052 |
1 |
ON3C14H25 |
AB3C14D25 |
-36.64 |
5.32 |
-8.94 |
0.73 |
0 |
|
|
259035 |
103158057 |
1 |
NO3C9H19 |
AB3C9D19 |
-155.55 |
1.98 |
-9.54 |
0.7 |
0 |
|
|
259036 |
103158058 |
1 |
NSO3C13H25 |
ABC3D13E25 |
-165.65 |
5.83 |
-9.27 |
0.85 |
0 |
|
|
259037 |
103158059 |
1 |
NO3C8H17 |
AB3C8D17 |
-153.78 |
2.78 |
-9.42 |
0.8 |
0 |
|
|
259038 |
103158062 |
1 |
BrNOC18H22 |
ABCD18E22 |
-29.43 |
3.25 |
-8.4 |
-0.65 |
0 |
|
|
259039 |
103158066 |
1 |
BrNOC16H24 |
ABCD16E24 |
-59.38 |
4.53 |
-8.31 |
0.19 |
0 |
|
|
259040 |
103158067 |
1 |
NO4C9H19 |
AB4C9D19 |
-185.75 |
3.3 |
-9.49 |
0.73 |
0 |
|
|
259041 |
103158072 |
1 |
NOC17H27 |
ABC17D27 |
-62.73 |
1.77 |
-9.04 |
0.38 |
0 |
|
|
259042 |
103158075 |
1 |
NO3C12H17 |
AB3C12D17 |
-112.33 |
1.88 |
-9.53 |
-0.02 |
0 |
|
|
259043 |
103158077 |
1 |
NO3C11H23 |
AB3C11D23 |
-168.77 |
2.66 |
-9.38 |
0.8 |
0 |
|
|
259044 |
103158079 |
1 |
NO4C9H19 |
AB4C9D19 |
-189.46 |
3.26 |
-9.73 |
0.53 |
0 |
|
|
259045 |
103158081 |
1 |
NO4C11H21 |
AB4C11D21 |
-193.09 |
4.15 |
-9.45 |
0.71 |
0 |
|
|
259046 |
103158082 |
1 |
BrNOC16H24 |
ABCD16E24 |
-52.98 |
1.82 |
-9.32 |
-0.16 |
0 |
|
|
259047 |
103158083 |
1 |
NO3C12H23 |
AB3C12D23 |
-163.96 |
2.86 |
-9.41 |
0.84 |
0 |
|
|
259048 |
103158092 |
1 |
FNOC16H24 |
ABCD16E24 |
-103.5 |
3.13 |
-9.31 |
-0.12 |
0 |
|
|
259049 |
103158093 |
1 |
FNOC16H24 |
ABCD16E24 |
-102.18 |
3.02 |
-9.28 |
-0.22 |
0 |