List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
262075 |
103268291 |
1 |
NO2C11H21 |
AB2C11D21 |
-108.55 |
3.31 |
-9.18 |
0.51 |
0 |
|
|
262076 |
103268333 |
1 |
NSO3C11H21 |
ABC3D11E21 |
-148.89 |
5.8 |
-8.7 |
0.59 |
0 |
|
|
262077 |
103268452 |
1 |
O2N3C8H19 |
A2B3C8D19 |
-111.97 |
3.3 |
-9.7 |
0.97 |
0 |
|
|
262078 |
103268551 |
2 |
NO2C6H10 |
AB2C6D10 |
-165.01 |
3.95 |
-9.57 |
0.26 |
0 |
|
|
262079 |
103268555 |
1 |
NO4C12H17 |
AB4C12D17 |
-121.82 |
2.57 |
-9.44 |
-0.46 |
0 |
|
|
262080 |
103268592 |
2 |
NOC6H12 |
ABC6D12 |
-114.65 |
4.22 |
-8.9 |
0.72 |
0 |
|
|
262081 |
103268693 |
1 |
NSO2C12H23 |
ABC2D12E23 |
-102.22 |
0.19 |
-8.5 |
-0.13 |
0 |
|
|
262082 |
103268895 |
1 |
BrNF2O3C10H10 |
ABC2D3E10F10 |
-190.94 |
5.06 |
-9.54 |
-0.85 |
0 |
|
|
262083 |
103269014 |
1 |
NSO2C12H15 |
ABC2D12E15 |
-63.23 |
4.27 |
-8.65 |
-0.8 |
0 |
|
|
262084 |
103269042 |
3 |
NOC4H5 |
ABC4D5 |
-62.3 |
6.09 |
-8.37 |
-0.77 |
0 |
|
|
262085 |
103269146 |
1 |
FNSO3H12C13 |
ABCD3E12F13 |
-114.56 |
3.07 |
-8.68 |
-1.52 |
0 |
|
|
262086 |
103269230 |
1 |
NO3C16H25 |
AB3C16D25 |
-135.26 |
4.29 |
-9.43 |
0.11 |
0 |
|
|
262087 |
103269361 |
1 |
O2N3C7H17 |
A2B3C7D17 |
-98.51 |
3.18 |
-9.67 |
1.0 |
0 |
|
|
262088 |
103269401 |
1 |
BrSO2N3C12H12 |
ABC2D3E12F12 |
30.29 |
9.44 |
-9.15 |
-0.96 |
0 |
|
|
262089 |
103269499 |
1 |
BrN3O3C14H16 |
AB3C3D14E16 |
-2.08 |
6.93 |
-9.18 |
-0.97 |
0 |
|
|
262090 |
103269603 |
1 |
BrN2O4C12H17 |
AB2C4D12E17 |
-86.66 |
9.76 |
-9.0 |
-0.85 |
0 |
|
|
262091 |
103269645 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-42.75 |
5.38 |
-9.22 |
-0.59 |
0 |
|
|
262092 |
103269662 |
1 |
BrO2N3C11H16 |
AB2C3D11E16 |
-67.46 |
5.66 |
-9.15 |
-0.65 |
0 |
|
|
262093 |
103269711 |
1 |
BrON2C13H15 |
ABC2D13E15 |
-6.93 |
4.51 |
-8.82 |
-0.73 |
0 |
|
|
262094 |
103269737 |
1 |
FON2C13H15 |
ABC2D13E15 |
-54.9 |
4.29 |
-8.81 |
-0.81 |
0 |
|
|
262095 |
103269826 |
1 |
F2N2O3C12H14 |
A2B2C3D12E14 |
-133.98 |
6.54 |
-9.27 |
-1.53 |
0 |
|
|
262096 |
103269897 |
1 |
ON6C11H18 |
AB6C11D18 |
65.84 |
9.44 |
-9.51 |
-1.35 |
0 |
|
|
262097 |
103269914 |
1 |
O3N5C12H21 |
A3B5C12D21 |
-41.11 |
3.31 |
-9.51 |
-1.01 |
0 |
|
|
262098 |
103270012 |
2 |
NOC7H10 |
ABC7D10 |
-51.45 |
2.91 |
-8.38 |
-0.17 |
0 |
|
|
262099 |
103270037 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-51.3 |
6.31 |
-9.07 |
-1.04 |
0 |
|
|
262100 |
103270228 |
1 |
ClNSO3C13H18 |
ABCD3E13F18 |
-134.19 |
3.72 |
-9.79 |
-0.88 |
0 |
|
|
262101 |
103270249 |
1 |
ClNSO3C14H18 |
ABCD3E14F18 |
-110.24 |
4.15 |
-9.82 |
-1.24 |
0 |
|
|
262102 |
103270395 |
1 |
NSO4C15H23 |
ABC4D15E23 |
-160.05 |
2.77 |
-9.78 |
-1.02 |
0 |
|
|
262103 |
103270540 |
1 |
OBr2N4C10H10 |
AB2C4D10E10 |
59.7 |
1.71 |
-8.74 |
-0.94 |
0 |
|
|
262104 |
103270661 |
1 |
NO3C16H25 |
AB3C16D25 |
-123.4 |
1.36 |
-8.25 |
0.29 |
0 |
|
|
262105 |
103270713 |
1 |
NO2C18H23 |
AB2C18D23 |
-58.67 |
2.79 |
-8.35 |
-0.46 |
0 |
|
|
262106 |
103270901 |
1 |
NOC15H23 |
ABC15D23 |
-56.88 |
3.41 |
-8.92 |
0.42 |
0 |
|
|
262107 |
103270911 |
1 |
ClN2O3C13H17 |
AB2C3D13E17 |
-53.0 |
7.45 |
-9.65 |
-1.59 |
0 |
|
|
262108 |
103270995 |
1 |
N2O3C18H36 |
A2B3C18D36 |
-193.01 |
0.65 |
-8.88 |
0.99 |
0 |
|
|
262109 |
103271034 |
1 |
ON2C13H24 |
AB2C13D24 |
-42.72 |
1.31 |
-8.54 |
1.24 |
0 |
|
|
262110 |
103271035 |
1 |
NOC11H23 |
ABC11D23 |
-53.18 |
2.57 |
-8.86 |
2.06 |
0 |
|
|
262111 |
103271083 |
1 |
BrNO2C12H20 |
ABC2D12E20 |
-69.59 |
3.19 |
-9.06 |
-0.05 |
0 |
|
|
262112 |
103271269 |
1 |
ON3C14H19 |
AB3C14D19 |
-1.88 |
3.88 |
-9.18 |
-0.48 |
0 |
|
|
262113 |
103271360 |
1 |
ON3C12H19 |
AB3C12D19 |
-23.78 |
3.86 |
-9.27 |
-0.61 |
0 |
|
|
262114 |
103271379 |
1 |
ON2C14H24 |
AB2C14D24 |
-27.88 |
3.98 |
-8.94 |
1.52 |
0 |
|
|
262115 |
103271396 |
1 |
NOC12H25 |
ABC12D25 |
-94.01 |
3.61 |
-8.93 |
2.83 |
0 |
|
|
262116 |
103271420 |
1 |
ON3C17H23 |
AB3C17D23 |
2.23 |
4.67 |
-8.92 |
-0.47 |
0 |
|
|
262117 |
103271443 |
1 |
NO2C11H21 |
AB2C11D21 |
-116.82 |
2.12 |
-9.22 |
2.24 |
0 |
|
|
262118 |
103271516 |
1 |
NO3C17H23 |
AB3C17D23 |
-98.75 |
3.47 |
-8.58 |
-0.12 |
0 |
|
|
262119 |
103271571 |
1 |
NOC18H29 |
ABC18D29 |
-70.9 |
3.98 |
-8.96 |
0.3 |
0 |
|
|
262120 |
103271611 |
1 |
NOSC12H25 |
ABCD12E25 |
-78.57 |
0.45 |
-8.55 |
0.82 |
0 |
|
|
262121 |
103271630 |
1 |
NOC14H29 |
ABC14D29 |
-87.61 |
2.52 |
-8.73 |
2.14 |
0 |
|
|
262122 |
103271724 |
1 |
N2O3C15H24 |
A2B3C15D24 |
-53.34 |
4.0 |
-9.27 |
-1.33 |
0 |
|
|
262123 |
103271733 |
1 |
NOC15H31 |
ABC15D31 |
-98.55 |
2.42 |
-8.64 |
2.14 |
0 |
|
|
262124 |
103271734 |
1 |
NOC17H27 |
ABC17D27 |
-59.06 |
2.49 |
-8.46 |
0.58 |
0 |
|
|
262125 |
103271824 |
1 |
BrFN3C14H17 |
ABC3D14E17 |
-0.25 |
5.63 |
-8.46 |
-0.16 |
0 |
|
|
262126 |
103271913 |
1 |
FO3N4C13H13 |
AB3C4D13E13 |
-64.54 |
4.97 |
-9.25 |
-1.52 |
0 |
|
|
262127 |
103271944 |
2 |
ON2C5H8 |
AB2C5D8 |
-21.37 |
4.5 |
-9.05 |
-1.0 |
0 |
|
|
262128 |
103271964 |
1 |
O2N5C12H13 |
A2B5C12D13 |
30.59 |
3.82 |
-9.22 |
-1.08 |
0 |
|
|
262129 |
103271994 |
1 |
FN3O3C14H14 |
AB3C3D14E14 |
-81.25 |
8.27 |
-9.07 |
-1.01 |
0 |
|
|
262130 |
103271997 |
1 |
O2N5C11H13 |
A2B5C11D13 |
20.21 |
4.72 |
-9.16 |
-1.06 |
0 |
|
|
262131 |
103272004 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-16.4 |
6.03 |
-8.99 |
-0.92 |
0 |
|
|
262132 |
103272029 |
1 |
O2N5C13H17 |
A2B5C13D17 |
9.78 |
2.15 |
-8.61 |
-0.83 |
0 |
|
|
262133 |
103272102 |
1 |
FO2N3C15H16 |
AB2C3D15E16 |
-56.55 |
2.63 |
-8.96 |
-0.62 |
0 |
|
|
262134 |
103272138 |
1 |
F2O2N3H11C13 |
A2B2C3D11E13 |
-106.34 |
8.25 |
-8.55 |
-0.97 |
0 |
|
|
262135 |
103272153 |
1 |
O2N3C15H17 |
A2B3C15D17 |
-35.6 |
8.17 |
-8.49 |
-0.59 |
0 |
|
|
262136 |
103272403 |
1 |
O3C16H22 |
A3B16C22 |
-123.39 |
1.77 |
-8.74 |
0.31 |
0 |
|
|
262137 |
103272659 |
1 |
NO5C14H17 |
AB5C14D17 |
-119.83 |
4.12 |
-9.5 |
-1.31 |
0 |
|
|
262138 |
103272699 |
1 |
O4C13H16 |
A4B13C16 |
-152.17 |
4.65 |
-9.24 |
-0.16 |
0 |
|
|
262139 |
103272717 |
1 |
O3C10H16 |
A3B10C16 |
-128.62 |
4.38 |
-10.14 |
0.54 |
0 |
|
|
262140 |
103272743 |
1 |
NF2O5H11C12 |
AB2C5D11E12 |
-197.02 |
4.61 |
-10.3 |
-1.72 |
0 |
|
|
262141 |
103272786 |
1 |
ClO3C13H15 |
AB3C13D15 |
-122.28 |
4.1 |
-9.12 |
-0.26 |
0 |
|
|
262142 |
103272872 |
1 |
FNO5C12H12 |
ABC5D12E12 |
-145.65 |
3.98 |
-9.94 |
-1.55 |
0 |
|
|
262143 |
103273026 |
1 |
NOC17H27 |
ABC17D27 |
-42.32 |
2.31 |
-8.78 |
0.26 |
0 |
|
|
262144 |
103273085 |
1 |
NOC17H33 |
ABC17D33 |
-89.95 |
1.19 |
-8.9 |
2.29 |
0 |
|
|
262145 |
103273146 |
1 |
NOC19H37 |
ABC19D37 |
-89.0 |
2.63 |
-8.72 |
2.11 |
0 |
|
|
262146 |
103273186 |
1 |
NO2C17H25 |
AB2C17D25 |
-42.37 |
2.18 |
-8.89 |
0.23 |
0 |
|
|
262147 |
103273265 |
1 |
NOC17H33 |
ABC17D33 |
-91.99 |
1.37 |
-8.91 |
2.27 |
0 |
|
|
262148 |
103273479 |
1 |
NOC19H31 |
ABC19D31 |
-54.17 |
2.64 |
-8.55 |
0.53 |
0 |
|
|
262149 |
103273527 |
1 |
NO2C16H23 |
AB2C16D23 |
-70.49 |
1.31 |
-8.16 |
0.39 |
0 |