List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
363064 |
127310095 |
1 |
F3O3N4C12H13 |
A3B3C4D12E13 |
-252.9 |
5.8 |
-9.91 |
-1.05 |
0 |
|
|
363065 |
127310096 |
1 |
O4N5C18H29 |
A4B5C18D29 |
-122.51 |
1.49 |
-9.36 |
-0.28 |
0 |
|
|
363066 |
127310097 |
1 |
O3N5C20H33 |
A3B5C20D33 |
-104.2 |
3.87 |
-8.98 |
-0.24 |
0 |
|
|
363067 |
127310098 |
1 |
O3N5C20H23 |
A3B5C20D23 |
-32.3 |
3.38 |
-9.15 |
-0.87 |
0 |
|
|
363068 |
127310099 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-4.77 |
7.04 |
-8.52 |
-0.18 |
0 |
|
|
363069 |
127310100 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-84.32 |
5.14 |
-8.92 |
-0.16 |
0 |
|
|
363070 |
127310101 |
1 |
SO2N4C19H26 |
AB2C4D19E26 |
-15.96 |
3.4 |
-9.02 |
-0.45 |
0 |
|
|
363071 |
127310102 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
15.3 |
5.18 |
-9.0 |
-0.67 |
0 |
|
|
363072 |
127310103 |
1 |
SO3N6C17H22 |
AB3C6D17E22 |
-38.56 |
4.69 |
-8.88 |
-1.24 |
0 |
|
|
363073 |
127310104 |
1 |
O3N6C19H32 |
A3B6C19D32 |
-94.14 |
3.21 |
-8.94 |
-0.26 |
0 |
|
|
363074 |
127310105 |
1 |
O2N5C18H31 |
A2B5C18D31 |
-40.65 |
3.46 |
-8.85 |
-0.24 |
0 |
|
|
363075 |
127310106 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-99.41 |
9.14 |
-8.86 |
-1.1 |
0 |
|
|
363076 |
127310107 |
1 |
O3N6C16H22 |
A3B6C16D22 |
-36.46 |
2.03 |
-9.22 |
-1.04 |
0 |
|
|
363077 |
127310108 |
1 |
O2N4C23H26 |
A2B4C23D26 |
11.12 |
5.53 |
-8.88 |
-0.63 |
0 |
|
|
363078 |
127310109 |
2 |
ON3C9H11 |
AB3C9D11 |
34.69 |
3.93 |
-9.22 |
-0.83 |
0 |
|
|
363079 |
127310110 |
1 |
O3N5C20H23 |
A3B5C20D23 |
-39.86 |
4.02 |
-9.04 |
-0.98 |
0 |
|
|
363080 |
127310111 |
1 |
O4N5C15H19 |
A4B5C15D19 |
-119.98 |
3.08 |
-9.19 |
-0.85 |
0 |
|
|
363081 |
127310112 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-106.54 |
4.44 |
-9.16 |
0.38 |
0 |
|
|
363082 |
127310113 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-14.35 |
2.49 |
-9.15 |
-0.89 |
0 |
|
|
363083 |
127310114 |
1 |
SO3N4C18H28 |
AB3C4D18E28 |
-108.42 |
5.3 |
-8.91 |
0.14 |
0 |
|
|
363084 |
127310115 |
1 |
O2N5C16H21 |
A2B5C16D21 |
11.98 |
8.06 |
-8.97 |
-0.06 |
0 |
|
|
363085 |
127310116 |
2 |
ON2C11H14 |
AB2C11D14 |
-26.69 |
5.21 |
-8.78 |
-0.59 |
0 |
|
|
363086 |
127310117 |
1 |
O2N6C21H28 |
A2B6C21D28 |
-2.83 |
2.47 |
-9.16 |
-0.68 |
0 |
|
|
363087 |
127310118 |
1 |
BrO2N5C16H20 |
AB2C5D16E20 |
16.34 |
8.37 |
-9.0 |
-0.44 |
0 |
|
|
363088 |
127310119 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-95.23 |
9.29 |
-8.98 |
0.18 |
0 |
|
|
363089 |
127310120 |
2 |
ON2C10H12 |
AB2C10D12 |
-23.06 |
5.57 |
-8.62 |
-0.36 |
0 |
|
|
363090 |
127310121 |
1 |
O3N7C17H21 |
A3B7C17D21 |
-18.2 |
6.76 |
-9.15 |
-0.83 |
0 |
|
|
363091 |
127310122 |
1 |
FO2N4C18H19 |
AB2C4D18E19 |
-50.6 |
3.5 |
-9.08 |
-0.85 |
0 |
|
|
363092 |
127310123 |
1 |
SO2N6C16H24 |
AB2C6D16E24 |
-12.55 |
1.5 |
-9.07 |
-0.6 |
0 |
|
|
363093 |
127310124 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-27.53 |
6.99 |
-9.01 |
0.24 |
0 |
|
|
363094 |
127310125 |
1 |
BrO2N5C16H22 |
AB2C5D16E22 |
-16.51 |
8.61 |
-8.99 |
-0.36 |
0 |
|
|
363095 |
127310126 |
1 |
SO2N7C14H21 |
AB2C7D14E21 |
24.29 |
2.06 |
-9.11 |
-0.79 |
0 |
|
|
363096 |
127310127 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-123.37 |
5.19 |
-8.96 |
0.44 |
0 |
|
|
363097 |
127310128 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-18.14 |
5.72 |
-9.26 |
-1.22 |
0 |
|
|
363098 |
127310129 |
4 |
NOC5H7 |
ABC5D7 |
-148.32 |
8.14 |
-9.03 |
-0.13 |
0 |
|
|
363099 |
127310130 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-50.31 |
6.62 |
-9.16 |
-1.03 |
0 |
|
|
363100 |
127310131 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-79.44 |
6.48 |
-9.22 |
0.07 |
0 |
|
|
363101 |
127310132 |
2 |
ON2C10H12 |
AB2C10D12 |
-23.42 |
8.88 |
-8.59 |
-0.27 |
0 |
|
|
363102 |
127310133 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-7.95 |
3.78 |
-9.14 |
-1.31 |
0 |
|
|
363103 |
127310134 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-115.8 |
3.86 |
-9.14 |
0.4 |
0 |
|
|
363104 |
127310135 |
2 |
ClON2C9H9 |
ABC2D9E9 |
-19.15 |
4.8 |
-9.1 |
-1.03 |
0 |
|
|
363105 |
127310136 |
1 |
N3O4C17H27 |
A3B4C17D27 |
-142.2 |
4.34 |
-9.1 |
0.5 |
0 |
|
|
363106 |
127310137 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-116.05 |
4.92 |
-8.99 |
0.32 |
0 |
|
|
363107 |
127310138 |
1 |
O3N6C18H22 |
A3B6C18D22 |
-32.64 |
7.59 |
-8.97 |
-1.18 |
0 |
|
|
363108 |
127310141 |
1 |
O3N5C18H19 |
A3B5C18D19 |
-28.88 |
4.95 |
-9.09 |
-1.24 |
0 |
|
|
363109 |
127310142 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-69.27 |
3.98 |
-8.88 |
-0.11 |
0 |
|
|
363110 |
127310143 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-78.87 |
6.38 |
-9.14 |
0.18 |
0 |
|
|
363111 |
127310144 |
1 |
O2N7C16H19 |
A2B7C16D19 |
44.42 |
4.03 |
-9.1 |
-1.34 |
0 |
|
|
363112 |
127310145 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-62.58 |
3.89 |
-9.1 |
-0.14 |
0 |
|
|
363113 |
127310146 |
1 |
O3N5C18H27 |
A3B5C18D27 |
-55.8 |
5.81 |
-9.04 |
-0.32 |
0 |
|
|
363114 |
127310147 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-31.49 |
9.28 |
-8.92 |
0.27 |
0 |
|
|
363115 |
127310148 |
1 |
ClFO2N4C18H18 |
ABC2D4E18F18 |
-56.77 |
4.98 |
-9.1 |
-1.02 |
0 |
|
|
363116 |
127310149 |
1 |
SO4N6C16H24 |
AB4C6D16E24 |
-97.93 |
11.03 |
-9.0 |
0.02 |
0 |
|
|
363117 |
127310150 |
1 |
FO2N4C20H25 |
AB2C4D20E25 |
-69.5 |
7.99 |
-8.49 |
-0.34 |
0 |
|
|
363118 |
127310151 |
2 |
ON2C10H12 |
AB2C10D12 |
-10.78 |
1.44 |
-8.65 |
-0.39 |
0 |
|
|
363119 |
127310152 |
1 |
SO2N4C16H22 |
AB2C4D16E22 |
-30.24 |
6.63 |
-9.01 |
-0.72 |
0 |
|
|
363120 |
127310153 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-85.74 |
7.74 |
-8.72 |
0.23 |
0 |
|
|
363121 |
127310154 |
2 |
ON2C11H13 |
AB2C11D13 |
-11.31 |
5.01 |
-9.15 |
-1.01 |
0 |
|
|
363122 |
127310155 |
1 |
BrO3N4C16H19 |
AB3C4D16E19 |
-63.18 |
3.45 |
-9.1 |
-1.01 |
0 |
|
|
363123 |
127310156 |
1 |
N4O4C17H26 |
A4B4C17D26 |
-137.85 |
4.98 |
-9.19 |
0.18 |
0 |
|
|
363124 |
127310157 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-28.36 |
1.84 |
-9.14 |
-0.2 |
0 |
|
|
363125 |
127310158 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-75.43 |
5.18 |
-9.04 |
0.44 |
0 |
|
|
363126 |
127310159 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-41.47 |
9.19 |
-8.89 |
0.14 |
0 |
|
|
363127 |
127310160 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-76.87 |
4.81 |
-9.06 |
0.56 |
0 |
|
|
363128 |
127310161 |
1 |
SN4O4C18H30 |
AB4C4D18E30 |
-151.86 |
5.2 |
-8.96 |
-0.02 |
0 |
|
|
363129 |
127310162 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-56.66 |
6.06 |
-8.69 |
-0.33 |
0 |
|
|
363130 |
127310163 |
1 |
SN4O4C18H30 |
AB4C4D18E30 |
-156.08 |
2.6 |
-9.21 |
0.07 |
0 |
|
|
363131 |
127310164 |
1 |
SO2N5C17H23 |
AB2C5D17E23 |
-8.24 |
7.38 |
-8.98 |
-0.48 |
0 |
|
|
363132 |
127310165 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-84.53 |
4.74 |
-8.87 |
0.05 |
0 |
|
|
363133 |
127310166 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-62.46 |
6.21 |
-8.96 |
-0.38 |
0 |
|
|
363134 |
127310167 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-60.59 |
5.86 |
-8.9 |
-0.7 |
0 |
|
|
363135 |
127310168 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-59.24 |
1.33 |
-8.9 |
0.65 |
0 |
|
|
363136 |
127310169 |
1 |
O2N5C18H19 |
A2B5C18D19 |
21.98 |
5.9 |
-9.09 |
-1.46 |
0 |
|
|
363137 |
127310170 |
2 |
O2N3C9H10 |
A2B3C9D10 |
-95.04 |
3.82 |
-9.12 |
-1.58 |
0 |
|
|
363138 |
127310171 |
1 |
O2N4C19H20 |
A2B4C19D20 |
9.39 |
6.58 |
-9.06 |
-1.16 |
0 |