List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
11063 |
110574 |
1 |
NaN2O4H11C17 |
AB2C4D11E17 |
-60.13 |
21.29 |
-8.15 |
-1.4 |
0 |
|
|
11064 |
110576 |
1 |
ClNNaO2H11C17 |
ABCD2E11F17 |
-79.6 |
2.98 |
-7.68 |
-0.36 |
0 |
|
|
11065 |
110589 |
1 |
NNaO2H14C18 |
ABC2D14E18 |
-83.64 |
6.34 |
-7.38 |
-0.3 |
0 |
|
|
11066 |
110592 |
1 |
SO2C7H8 |
AB2C7D8 |
-49.37 |
3.47 |
-8.71 |
-0.4 |
0 |
|
|
11067 |
110721 |
1 |
N2O3C7H12 |
A2B3C7D12 |
-128.4 |
7.38 |
-9.79 |
-0.32 |
0 |
|
|
11068 |
110722 |
1 |
NO3C7H11 |
AB3C7D11 |
-136.86 |
6.21 |
-10.82 |
-0.3 |
0 |
|
|
11069 |
110723 |
1 |
OSCl2N3C23H31 |
ABC2D3E23F31 |
-76.66 |
7.87 |
-8.99 |
-0.68 |
0 |
|
|
11070 |
110740 |
2 |
OC4H8 |
AB4C8 |
-127.82 |
2.26 |
-10.94 |
0.93 |
0 |
|
|
11071 |
110741 |
1 |
ClNC13H30 |
ABC13D30 |
-97.58 |
1.03 |
-8.8 |
1.91 |
0 |
|
|
11072 |
110751 |
1 |
NO7C28H47 |
AB7C28D47 |
-322.71 |
3.85 |
-8.81 |
0.05 |
0 |
|
|
11073 |
110778 |
2 |
NC3H8 |
AB3C8 |
-12.35 |
2.43 |
-8.72 |
2.76 |
0 |
|
|
11074 |
110786 |
1 |
OC9H18 |
AB9C18 |
-81.58 |
3.04 |
-9.86 |
0.83 |
0 |
|
|
11075 |
110788 |
2 |
OC2H4 |
AB2C4 |
-78.21 |
2.19 |
-9.74 |
0.15 |
0 |
|
|
11076 |
110791 |
1 |
ClNO3C10H14 |
ABC3D10E14 |
-143.84 |
1.33 |
-9.73 |
-0.8 |
0 |
|
|
11077 |
110794 |
1 |
ClO2C5H9 |
AB2C5D9 |
-115.66 |
3.89 |
-11.04 |
-0.3 |
0 |
|
|
11078 |
110795 |
1 |
NO4C14H19 |
AB4C14D19 |
-172.53 |
4.7 |
-8.69 |
0.25 |
0 |
|
|
11079 |
110798 |
1 |
ClNOC3H10 |
ABCD3E10 |
-90.4 |
3.33 |
-9.42 |
1.7 |
0 |
|
|
11080 |
110800 |
1 |
O4C39H76 |
A4B39C76 |
-345.87 |
3.41 |
-10.5 |
0.67 |
0 |
|
|
11081 |
110805 |
1 |
ON2C19H22 |
AB2C19D22 |
3.53 |
4.65 |
-8.62 |
0.19 |
0 |
|
|
11082 |
110808 |
1 |
NaSN4O5H15C17 |
ABC4D5E15F17 |
-123.17 |
5.08 |
-8.71 |
-1.13 |
0 |
|
|
11083 |
110821 |
1 |
NC16H19 |
AB16C19 |
35.76 |
1.49 |
-9.0 |
0.29 |
0 |
|
|
11084 |
110832 |
1 |
ClS2N4O7H15C20 |
AB2C4D7E15F20 |
-142.44 |
6.93 |
-9.43 |
-1.74 |
0 |
|
|
11085 |
110834 |
1 |
OCl2C8H8 |
AB2C8D8 |
-47.33 |
1.4 |
-9.65 |
-0.41 |
0 |
|
|
11086 |
110837 |
2 |
NO2H6C7 |
AB2C6D7 |
-82.72 |
4.96 |
-10.76 |
-1.42 |
0 |
|
|
11087 |
110845 |
1 |
O3N5H15C17 |
A3B5C15D17 |
79.96 |
4.21 |
-8.83 |
-1.6 |
0 |
|
|
11088 |
110863 |
1 |
N4O5H16C17 |
A4B5C16D17 |
-28.17 |
8.41 |
-8.86 |
-1.82 |
0 |
|
|
11089 |
110869 |
2 |
N3O3H16C17 |
A3B3C16D17 |
-49.06 |
5.08 |
-9.03 |
-1.29 |
0 |
|
|
11090 |
110887 |
1 |
ON2C16H24 |
AB2C16D24 |
-45.51 |
3.09 |
-8.84 |
0.19 |
0 |
|
|
11091 |
110889 |
1 |
N3O3C16H21 |
A3B3C16D21 |
-120.35 |
5.47 |
-9.01 |
-0.16 |
0 |
|
|
11092 |
110891 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-84.04 |
1.83 |
-9.05 |
0.1 |
0 |
|
|
11093 |
110893 |
2 |
ClN3O3C19H19 |
AB3C3D19E19 |
-103.41 |
3.91 |
-8.49 |
-1.53 |
0 |
|
|
11094 |
110895 |
1 |
NC5H5O5 |
AB5C5D5 |
-200.88 |
4.84 |
-11.25 |
-0.75 |
0 |
|
|
11095 |
110897 |
4 |
OC2H3 |
AB2C3 |
-186.7 |
4.25 |
-10.98 |
0.16 |
0 |
|
|
11096 |
110899 |
1 |
ClN2O2C17H25 |
AB2C2D17E25 |
-102.84 |
1.94 |
-8.93 |
0.01 |
0 |
|
|
11097 |
110902 |
1 |
O2C11H20 |
A2B11C20 |
-133.53 |
1.75 |
-10.36 |
1.01 |
0 |
|
|
11098 |
110904 |
1 |
N2O2C11H14 |
A2B2C11D14 |
-40.53 |
2.71 |
-8.61 |
0.03 |
0 |
|
|
11099 |
110905 |
1 |
C19H40 |
A19B40 |
-96.06 |
0.09 |
-10.47 |
4.03 |
0 |
|
|
11100 |
110907 |
1 |
O3C7H14 |
A3B7C14 |
-147.02 |
1.16 |
-10.04 |
1.87 |
0 |
|
|
11101 |
110908 |
2 |
NO2C10H10 |
AB2C10D10 |
-33.95 |
6.5 |
-8.68 |
-0.91 |
0 |
|
|
11102 |
110915 |
1 |
NSC12H19 |
ABC12D19 |
-25.78 |
1.73 |
-8.7 |
0.48 |
0 |
|
|
11103 |
110931 |
1 |
NC7H15 |
AB7C15 |
-30.02 |
1.9 |
-9.26 |
3.43 |
0 |
|
|
11104 |
110932 |
1 |
NC8H17 |
AB8C17 |
-33.94 |
1.89 |
-9.12 |
3.6 |
0 |
|
|
11105 |
110944 |
2 |
ClC2H3 |
AB2C3 |
-19.7 |
1.41 |
-10.28 |
-0.01 |
0 |
|
|
11106 |
110950 |
2 |
O2C5H8 |
A2B5C8 |
-180.99 |
2.28 |
-9.99 |
-0.39 |
0 |
|
|
11107 |
110951 |
1 |
Cl2F2C3H4 |
A2B2C3D4 |
-138.52 |
2.57 |
-11.22 |
-0.43 |
0 |
|
|
11108 |
110962 |
1 |
SO7C8H14 |
AB7C8D14 |
-315.05 |
7.11 |
-11.22 |
-0.44 |
0 |
|
|
11109 |
110972 |
2 |
O2C11H15 |
A2B11C15 |
-145.06 |
2.3 |
-9.73 |
0.73 |
0 |
|
|
11110 |
110989 |
2 |
C5H7 |
A5B7 |
9.96 |
0.21 |
-9.43 |
1.33 |
0 |
|
|
11111 |
110990 |
2 |
Br2O2C7H7 |
A2B2C7D7 |
-147.74 |
5.2 |
-10.57 |
-1.3 |
0 |
|
|
11112 |
111024 |
1 |
FNO3C5H10 |
ABC3D5E10 |
-193.3 |
3.78 |
-10.03 |
0.4 |
0 |