List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
427866 |
135164693 |
1 |
BrClON3C17H19 |
ABCD3E17F19 |
30.39 |
2.21 |
-9.32 |
-0.72 |
0 |
|
|
427867 |
135164694 |
1 |
BrClN2O2C19H20 |
ABC2D2E19F20 |
-13.0 |
3.15 |
-9.23 |
-0.54 |
0 |
|
|
427868 |
135164720 |
1 |
BrClON2C22H28 |
ABCD2E22F28 |
-22.39 |
4.96 |
-8.98 |
-0.58 |
0 |
|
|
427869 |
135164728 |
1 |
BrClON2C23H30 |
ABCD2E23F30 |
-26.73 |
5.1 |
-8.89 |
-0.56 |
0 |
|
|
427870 |
135164731 |
1 |
BrClN3C18H21 |
ABC3D18E21 |
53.08 |
4.23 |
-8.48 |
-0.29 |
0 |
|
|
427871 |
135164735 |
1 |
BrClN2O4C28H30 |
ABC2D4E28F30 |
-104.99 |
6.41 |
-9.05 |
-0.87 |
0 |
|
|
427872 |
135164766 |
1 |
BrClO2N4C24H28 |
ABC2D4E24F28 |
-15.41 |
2.06 |
-9.05 |
-0.7 |
0 |
|
|
427873 |
135164826 |
1 |
ON3C23H31 |
AB3C23D31 |
5.61 |
1.92 |
-8.83 |
-0.64 |
0 |
|
|
427874 |
135164828 |
1 |
OSN3C23H31 |
ABC3D23E31 |
24.52 |
4.17 |
-8.74 |
-0.71 |
0 |
|
|
427875 |
135164829 |
1 |
O2N3C25H33 |
A2B3C25D33 |
-45.72 |
8.84 |
-8.87 |
-0.67 |
0 |
|
|
427876 |
135164830 |
1 |
ON3C21H25 |
AB3C21D25 |
60.81 |
4.91 |
-8.92 |
-0.74 |
0 |
|
|
427877 |
135164861 |
1 |
SCl2N3O3C22H27 |
AB2C3D3E22F27 |
-69.06 |
5.97 |
-9.05 |
-1.13 |
0 |
|
|
427878 |
135164863 |
1 |
BrClO2N3C22H25 |
ABC2D3E22F25 |
-8.31 |
3.76 |
-9.21 |
-0.78 |
0 |
|
|
427879 |
135164883 |
1 |
BrClO2N3C23H27 |
ABC2D3E23F27 |
-41.83 |
5.01 |
-8.96 |
-0.68 |
0 |
|
|
427880 |
135164888 |
1 |
SO2N6C24H30 |
AB2C6D24E30 |
25.25 |
2.32 |
-9.17 |
-1.18 |
0 |
|
|
427881 |
135164897 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-30.88 |
0.9 |
-9.05 |
0.02 |
0 |
|
|
427882 |
135164901 |
1 |
O2N3C22H29 |
A2B3C22D29 |
-18.14 |
4.49 |
-8.76 |
-0.3 |
0 |
|
|
427883 |
135164902 |
1 |
BrClON2C23H26 |
ABCD2E23F26 |
23.07 |
5.07 |
-8.87 |
-0.74 |
0 |
|
|
427884 |
135164903 |
1 |
O2N3C21H27 |
A2B3C21D27 |
0.94 |
1.74 |
-8.78 |
-0.22 |
0 |
|
|
427885 |
135164908 |
1 |
O2N3C22H29 |
A2B3C22D29 |
-19.02 |
4.01 |
-8.8 |
-0.27 |
0 |
|
|
427886 |
135164921 |
1 |
N3O4C23H29 |
A3B4C23D29 |
-103.59 |
1.71 |
-8.7 |
-0.16 |
0 |
|
|
427887 |
135164973 |
2 |
O3N7C30H40 |
A3B7C30D40 |
-144.46 |
4.47 |
-9.28 |
0.15 |
0 |
|
|
427888 |
135164974 |
1 |
NO2C15H29 |
AB2C15D29 |
-129.76 |
5.23 |
-8.81 |
0.91 |
0 |
|
|
427889 |
135164975 |
1 |
OC14H28 |
AB14C28 |
-105.27 |
2.81 |
-9.58 |
0.87 |
0 |
|
|
427890 |
135164976 |
1 |
OC10H14 |
AB10C14 |
-31.66 |
1.95 |
-9.11 |
0.27 |
0 |
|
|
427891 |
135164977 |
2 |
N4C20H21 |
A4B20C21 |
144.34 |
6.36 |
-8.1 |
-0.61 |
0 |
|
|
427892 |
135164978 |
1 |
O2N7C43H47 |
A2B7C43D47 |
53.83 |
8.19 |
-8.18 |
-0.91 |
0 |
|
|
427893 |
135164979 |
1 |
ClO4N5H32C33 |
AB4C5D32E33 |
-41.33 |
8.66 |
-8.47 |
-1.37 |
0 |
|
|
427894 |
135165018 |
1 |
NOC13H27 |
ABC13D27 |
-72.44 |
2.47 |
-8.71 |
2.14 |
0 |
|
|
427895 |
135165026 |
1 |
N2C21H42 |
A2B21C42 |
-72.57 |
2.2 |
-8.35 |
2.96 |
0 |
|
|
427896 |
135165029 |
1 |
N2O2C19H38 |
A2B2C19D38 |
-131.52 |
2.42 |
-8.25 |
2.33 |
0 |
|
|
427897 |
135165033 |
1 |
NO2C21H41 |
AB2C21D41 |
-154.02 |
2.45 |
-8.46 |
2.38 |
0 |
|
|
427898 |
135165038 |
1 |
O2N3C20H35 |
A2B3C20D35 |
-101.34 |
1.53 |
-8.26 |
0.07 |
0 |
|
|
427899 |
135165178 |
1 |
ClO4N8C39H45 |
AB4C8D39E45 |
-85.14 |
5.44 |
-8.67 |
-0.38 |
0 |
|
|
427900 |
135165282 |
1 |
ClO3N8C40H51 |
AB3C8D40E51 |
-77.1 |
5.88 |
-8.61 |
-0.29 |
0 |
|
|
427901 |
135165290 |
1 |
ClNO3C20H24 |
ABC3D20E24 |
-8.93 |
5.86 |
-8.77 |
-0.03 |
0 |
|
|
427902 |
135165296 |
1 |
NO3C12H13 |
AB3C12D13 |
-90.4 |
3.62 |
-9.34 |
-0.43 |
0 |
|
|
427903 |
135165314 |
1 |
ON2C10H12 |
AB2C10D12 |
-6.98 |
8.56 |
-8.38 |
-0.31 |
0 |
|
|
427904 |
135165315 |
1 |
NOC11H13 |
ABC11D13 |
-15.51 |
4.39 |
-8.03 |
-0.26 |
0 |
|
|
427905 |
135165335 |
2 |
OC7H10 |
AB7C10 |
-79.69 |
1.99 |
-9.18 |
0.26 |
0 |
|
|
427906 |
135165370 |
2 |
OC6H7 |
AB6C7 |
-78.1 |
5.47 |
-9.01 |
-0.64 |
0 |
|
|
427907 |
135165376 |
1 |
FNOC9H16 |
ABCD9E16 |
-83.58 |
3.25 |
-9.04 |
-0.27 |
0 |
|
|
427908 |
135165437 |
1 |
FNC9H18 |
ABC9D18 |
-68.92 |
0.13 |
-8.95 |
2.39 |
0 |
|
|
427909 |
135165444 |
1 |
ON2C9H16 |
AB2C9D16 |
-19.59 |
4.93 |
-9.23 |
0.08 |
0 |
|
|
427910 |
135165470 |
1 |
NOC11H21 |
ABC11D21 |
-47.23 |
2.14 |
-8.7 |
-0.06 |
0 |
|
|
427911 |
135165471 |
2 |
NOC6H11 |
ABC6D11 |
-87.61 |
2.28 |
-9.01 |
-0.16 |
0 |
|
|
427912 |
135165472 |
1 |
NO3C14H25 |
AB3C14D25 |
-160.17 |
4.03 |
-9.6 |
-0.09 |
0 |
|
|
427913 |
135165473 |
1 |
NOC9H17 |
ABC9D17 |
-44.22 |
2.11 |
-9.2 |
-0.03 |
0 |
|
|
427914 |
135165474 |
1 |
NOC10H21 |
ABC10D21 |
-65.14 |
1.47 |
-8.77 |
2.49 |
0 |
|
|
427915 |
135165475 |
1 |
NO2C10H19 |
AB2C10D19 |
-100.42 |
3.65 |
-9.2 |
0.52 |
0 |