List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
325972 |
126685848 |
2 |
O2C5H8 |
A2B5C8 |
-204.61 |
5.98 |
-10.76 |
0.45 |
0 |
|
|
325973 |
126685856 |
2 |
NC7H16 |
AB7C16 |
-65.78 |
0.76 |
-9.22 |
3.2 |
0 |
|
|
325974 |
126685859 |
2 |
NC7H16 |
AB7C16 |
-52.37 |
1.6 |
-8.87 |
3.35 |
0 |
|
|
325975 |
126685861 |
1 |
O3H20C23 |
A3B20C23 |
-22.56 |
6.93 |
-8.91 |
-0.47 |
0 |
|
|
325976 |
126685863 |
2 |
OH11C12 |
AB11C12 |
21.44 |
4.22 |
-8.55 |
-0.18 |
0 |
|
|
325977 |
126685870 |
1 |
O2H30C33 |
A2B30C33 |
49.38 |
1.76 |
-8.42 |
-0.09 |
0 |
|
|
325978 |
126685883 |
2 |
NO2C13H16 |
AB2C13D16 |
-19.3 |
0.53 |
-8.03 |
0.14 |
0 |
|
|
325979 |
126685887 |
2 |
O3C17H21 |
A3B17C21 |
-187.55 |
2.73 |
-8.22 |
-0.1 |
0 |
|
|
325980 |
126685888 |
2 |
O3C17H21 |
A3B17C21 |
-187.89 |
0.2 |
-8.12 |
0.12 |
0 |
|
|
325981 |
126685891 |
1 |
ClO3N4C23H27 |
AB3C4D23E27 |
-89.23 |
4.55 |
-9.11 |
-0.98 |
0 |
|
|
325982 |
126685893 |
1 |
ON2C9H18 |
AB2C9D18 |
-67.62 |
2.43 |
-8.87 |
1.17 |
0 |
|
|
325983 |
126685898 |
1 |
OF5N7H22C23 |
AB5C7D22E23 |
-165.15 |
9.32 |
-9.03 |
-0.92 |
0 |
|
|
325984 |
126685899 |
2 |
ON3C7H8 |
AB3C7D8 |
28.06 |
4.24 |
-9.02 |
-0.12 |
0 |
|
|
325985 |
126685902 |
1 |
FNO4C25H28 |
ABC4D25E28 |
-173.52 |
9.67 |
-8.55 |
-0.86 |
0 |
|
|
325986 |
126685905 |
1 |
ClSO2N4C23H25 |
ABC2D4E23F25 |
-12.78 |
9.41 |
-9.55 |
-1.38 |
0 |
|
|
325987 |
126685908 |
1 |
O4C7H16 |
A4B7C16 |
-199.16 |
3.99 |
-10.09 |
1.34 |
0 |
|
|
325988 |
126685917 |
1 |
S2N5O5H21C22 |
A2B5C5D21E22 |
-71.08 |
11.42 |
-9.38 |
-1.14 |
0 |
|
|
325989 |
126685920 |
1 |
ION3C8H16 |
ABC3D8E16 |
-29.39 |
4.01 |
-8.57 |
-1.46 |
0 |
|
|
325990 |
126685922 |
1 |
ClFO2N6C21H24 |
ABC2D6E21F24 |
-65.06 |
5.01 |
-8.82 |
-0.84 |
0 |
|
|
325991 |
126685926 |
1 |
IN2O2C9H17 |
AB2C2D9E17 |
-80.48 |
2.51 |
-8.85 |
-1.55 |
0 |
|
|
325992 |
126685927 |
1 |
ION3C9H18 |
ABC3D9E18 |
-31.9 |
3.36 |
-8.83 |
-1.49 |
0 |
|
|
325993 |
126685929 |
1 |
ION3C8H16 |
ABC3D8E16 |
-26.91 |
3.51 |
-8.81 |
-1.58 |
0 |
|
|
325994 |
126685931 |
1 |
IN2O2C8H15 |
AB2C2D8E15 |
-75.77 |
3.86 |
-8.83 |
-1.65 |
0 |
|
|
325995 |
126685938 |
1 |
O5C15H18 |
A5B15C18 |
-210.17 |
4.13 |
-9.69 |
-0.12 |
0 |
|
|
325996 |
126685939 |
1 |
FO2N3C18H28 |
AB2C3D18E28 |
-152.85 |
2.38 |
-8.62 |
0.1 |
0 |
|
|
325997 |
126685943 |
1 |
Cl2N3O4C17H19 |
A2B3C4D17E19 |
-131.93 |
5.96 |
-9.27 |
-1.83 |
0 |
|
|
325998 |
126685953 |
1 |
N4O5C21H24 |
A4B5C21D24 |
-155.85 |
8.52 |
-8.71 |
-0.82 |
0 |
|
|
325999 |
126685955 |
1 |
N4O5C26H30 |
A4B5C26D30 |
-161.27 |
9.62 |
-8.59 |
-0.76 |
0 |
|
|
326000 |
126685958 |
1 |
Cl2N4O5C25H32 |
A2B4C5D25E32 |
-227.1 |
10.97 |
-8.86 |
-0.91 |
0 |
|
|
326001 |
126685967 |
1 |
N3O5C26H33 |
A3B5C26D33 |
-188.06 |
9.88 |
-8.68 |
-0.79 |
0 |
|
|
326002 |
126685973 |
1 |
N2O5C18H20 |
A2B5C18D20 |
-176.98 |
11.35 |
-8.66 |
-0.64 |
0 |
|
|
326003 |
126685986 |
1 |
N3O5C24H29 |
A3B5C24D29 |
-185.15 |
8.16 |
-8.62 |
-0.76 |
0 |
|
|
326004 |
126685988 |
1 |
N3O5C28H37 |
A3B5C28D37 |
-200.46 |
8.55 |
-8.64 |
-0.79 |
0 |
|
|
326005 |
126685996 |
1 |
ClN3O6C22H24 |
AB3C6D22E24 |
-224.68 |
8.43 |
-8.68 |
-1.06 |
0 |
|
|
326006 |
126686001 |
1 |
ClN3O5C21H26 |
AB3C5D21E26 |
-209.47 |
13.55 |
-8.56 |
-0.91 |
0 |
|
|
326007 |
126686002 |
1 |
N3O5C21H25 |
A3B5C21D25 |
-174.1 |
13.59 |
-8.49 |
-0.83 |
0 |
|
|
326008 |
126686009 |
1 |
Cl2N4O5C24H32 |
A2B4C5D24E32 |
-230.22 |
12.44 |
-8.65 |
-0.76 |
0 |
|
|
326009 |
126686015 |
1 |
ClN4O5C21H25 |
AB4C5D21E25 |
-204.3 |
10.02 |
-8.83 |
-0.91 |
0 |
|
|
326010 |
126686016 |
1 |
N4O5C21H24 |
A4B5C21D24 |
-162.92 |
12.75 |
-8.54 |
-0.8 |
0 |
|
|
326011 |
126686030 |
1 |
N2O5C19H20 |
A2B5C19D20 |
-176.89 |
11.89 |
-8.51 |
-0.68 |
0 |
|
|
326012 |
126686032 |
1 |
N3O5C20H23 |
A3B5C20D23 |
-165.14 |
10.79 |
-8.42 |
-0.88 |
0 |
|
|
326013 |
126686033 |
1 |
F3N3O7H20C22 |
A3B3C7D20E22 |
-376.27 |
6.21 |
-8.77 |
-1.04 |
0 |
|
|
326014 |
126686042 |
1 |
ClN4O5C19H23 |
AB4C5D19E23 |
-194.24 |
12.62 |
-8.45 |
-0.65 |
0 |
|
|
326015 |
126686044 |
1 |
Cl2N4O6C21H26 |
A2B4C6D21E26 |
-251.84 |
11.29 |
-8.43 |
-0.89 |
0 |
|
|
326016 |
126686057 |
1 |
Cl2N4O5C25H32 |
A2B4C5D25E32 |
-235.43 |
9.02 |
-8.64 |
-0.79 |
0 |
|
|
326017 |
126686066 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-148.6 |
8.94 |
-8.62 |
-0.78 |
0 |
|
|
326018 |
126686067 |
1 |
ClN3O5C22H28 |
AB3C5D22E28 |
-209.25 |
11.4 |
-8.52 |
-0.73 |
0 |
|
|
326019 |
126686068 |
1 |
N3O5C22H27 |
A3B5C22D27 |
-174.4 |
12.94 |
-8.46 |
-0.62 |
0 |
|
|
326020 |
126686070 |
1 |
N4O5C23H28 |
A4B5C23D28 |
-156.86 |
8.98 |
-8.68 |
-0.8 |
0 |
|
|
326021 |
126686071 |
1 |
N2O4C17H18 |
A2B4C17D18 |
-128.73 |
8.63 |
-8.48 |
-0.79 |
0 |