List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
48064 |
10536907 |
1 |
NO2C13H18 |
AB2C13D18 |
-32.06 |
1.98 |
0.0 |
0.0 |
0 |
|
|
48065 |
10536908 |
1 |
SN4C10H12 |
AB4C10D12 |
81.12 |
3.24 |
-8.75 |
-0.33 |
0 |
|
|
48066 |
10536909 |
2 |
OC7H10 |
AB7C10 |
-73.69 |
3.64 |
-9.51 |
0.19 |
0 |
|
|
48067 |
10536911 |
2 |
OC7H10 |
AB7C10 |
-79.67 |
3.34 |
-9.41 |
0.23 |
0 |
|
|
48068 |
10536926 |
1 |
OC15H24 |
AB15C24 |
-51.53 |
2.2 |
-9.73 |
2.31 |
0 |
|
|
48069 |
10536932 |
2 |
NC7H12 |
AB7C12 |
-4.29 |
4.9 |
-9.57 |
0.88 |
0 |
|
|
48070 |
10536963 |
1 |
NO3C12H15 |
AB3C12D15 |
-129.49 |
3.7 |
-9.81 |
-1.08 |
0 |
|
|
48071 |
10536967 |
1 |
OSN3C10H11 |
ABC3D10E11 |
14.12 |
2.62 |
-8.4 |
-0.71 |
0 |
|
|
48072 |
10536979 |
1 |
ClNO2H8C11 |
ABC2D8E11 |
-26.9 |
4.63 |
-9.24 |
-1.58 |
0 |
|
|
48073 |
10536980 |
1 |
ClON3H8C10 |
ABC3D8E10 |
69.72 |
5.6 |
-9.33 |
-1.27 |
0 |
|
|
48074 |
10536983 |
1 |
BrNOC8H16 |
ABCD8E16 |
-70.91 |
4.29 |
-9.49 |
-0.64 |
0 |
|
|
48075 |
10536988 |
2 |
O2C6H7 |
A2B6C7 |
-148.06 |
5.48 |
-9.37 |
-0.66 |
0 |
|
|
48076 |
10536990 |
2 |
O2C6H7 |
A2B6C7 |
-152.26 |
5.35 |
-10.3 |
0.37 |
0 |
|
|
48077 |
10537016 |
2 |
OC7H11 |
AB7C11 |
-80.67 |
2.29 |
-8.9 |
1.14 |
0 |
|
|
48078 |
10537022 |
1 |
SN2C12H18 |
AB2C12D18 |
16.44 |
2.28 |
-8.63 |
-0.1 |
0 |
|
|
48079 |
10537028 |
1 |
OC15H26 |
AB15C26 |
-48.24 |
1.51 |
-10.09 |
1.55 |
0 |
|
|
48080 |
10537030 |
2 |
SC6H7 |
AB6C7 |
14.71 |
1.38 |
-8.6 |
-0.24 |
0 |
|
|
48081 |
10537032 |
1 |
OSiC13H22 |
ABC13D22 |
-80.83 |
2.68 |
-8.74 |
0.38 |
0 |
|
|
48082 |
10537035 |
1 |
N2O4C7H10 |
A2B4C7D10 |
-159.64 |
4.18 |
-10.32 |
-0.64 |
0 |
|
|
48083 |
10537054 |
1 |
NO3C12H17 |
AB3C12D17 |
-125.68 |
3.59 |
-8.57 |
0.15 |
0 |
|
|
48084 |
10537055 |
1 |
NO3C12H17 |
AB3C12D17 |
-120.73 |
5.06 |
-8.17 |
0.22 |
0 |
|
|
48085 |
10537056 |
1 |
NO3C12H17 |
AB3C12D17 |
-115.97 |
2.43 |
-9.88 |
0.35 |
0 |
|
|
48086 |
10537061 |
1 |
N3H13C14 |
A3B13C14 |
92.61 |
5.87 |
-9.64 |
-0.63 |
0 |
|
|
48087 |
10537071 |
1 |
NOSC12H17 |
ABCD12E17 |
11.6 |
4.22 |
-8.57 |
-0.38 |
0 |
|
|
48088 |
10537079 |
1 |
ClN3C11H14 |
AB3C11D14 |
28.71 |
4.53 |
-8.52 |
-0.05 |
0 |
|
|
48089 |
10537091 |
1 |
N2O2H8C13 |
A2B2C8D13 |
-6.81 |
3.51 |
-8.77 |
-1.26 |
0 |
|
|
48090 |
10537092 |
1 |
FO3C12H13 |
AB3C12D13 |
-130.02 |
1.22 |
-9.44 |
-0.31 |
0 |
|
|
48091 |
10537095 |
1 |
SO6C7H12 |
AB6C7D12 |
-251.21 |
3.23 |
-9.51 |
-0.71 |
0 |
|
|
48092 |
10537110 |
2 |
NC7H11 |
AB7C11 |
11.67 |
0.45 |
-8.5 |
0.51 |
0 |
|
|
48093 |
10537119 |
1 |
O3C13H20 |
A3B13C20 |
-148.78 |
2.76 |
-10.17 |
-0.11 |
0 |
|
|
48094 |
10537121 |
1 |
O3C13H20 |
A3B13C20 |
-150.95 |
4.38 |
-9.71 |
1.0 |
0 |
|
|
48095 |
10537126 |
1 |
O3C13H20 |
A3B13C20 |
-121.62 |
3.66 |
-9.71 |
0.67 |
0 |
|
|
48096 |
10537127 |
1 |
OC16H16 |
AB16C16 |
-5.81 |
1.29 |
-8.33 |
-0.19 |
0 |
|
|
48097 |
10537141 |
1 |
OSC13H20 |
ABC13D20 |
-55.04 |
0.31 |
-8.63 |
-0.15 |
0 |
|
|
48098 |
10537147 |
1 |
ClOC13H17 |
ABC13D17 |
-52.32 |
1.83 |
-9.31 |
0.4 |
0 |
|
|
48099 |
10537152 |
1 |
BrOH9C10 |
ABC9D10 |
-19.59 |
1.92 |
-9.8 |
-0.83 |
0 |
|
|
48100 |
10537156 |
1 |
NPO5C7H16 |
ABC5D7E16 |
-291.28 |
4.8 |
-10.14 |
0.56 |
0 |
|
|
48101 |
10537159 |
1 |
NO5C10H11 |
AB5C10D11 |
-114.93 |
6.91 |
-10.66 |
-1.72 |
0 |
|
|
48102 |
10537160 |
1 |
N3O4C9H11 |
A3B4C9D11 |
-120.9 |
2.41 |
-10.3 |
-0.96 |
0 |
|
|
48103 |
10537168 |
1 |
NO4C11H15 |
AB4C11D15 |
-132.69 |
4.4 |
-9.88 |
0.1 |
0 |
|
|
48104 |
10537171 |
1 |
NO2H11C14 |
AB2C11D14 |
-2.77 |
1.84 |
-9.67 |
-1.08 |
0 |
|
|
48105 |
10537184 |
1 |
NO3C12H19 |
AB3C12D19 |
-128.86 |
2.09 |
-9.03 |
0.18 |
0 |
|
|
48106 |
10537185 |
1 |
NOC15H15 |
ABC15D15 |
-3.04 |
2.91 |
-8.86 |
0.1 |
0 |
|
|
48107 |
10537198 |
1 |
NO2C13H23 |
AB2C13D23 |
-102.86 |
2.71 |
-9.24 |
0.68 |
0 |
|
|
48108 |
10537200 |
1 |
ON2C13H25 |
AB2C13D25 |
-24.13 |
2.95 |
0.0 |
0.0 |
0 |
|
|
48109 |
10537201 |
1 |
NOSC12H19 |
ABCD12E19 |
-35.79 |
1.82 |
-8.55 |
-0.01 |
0 |
|
|
48110 |
10537243 |
1 |
O3C13H22 |
A3B13C22 |
-155.82 |
3.85 |
-9.7 |
1.12 |
0 |
|
|
48111 |
10537253 |
1 |
N2C15H18 |
A2B15C18 |
60.23 |
4.19 |
-8.99 |
0.26 |
0 |
|
|
48112 |
10537256 |
2 |
OC7H13 |
AB7C13 |
-112.47 |
3.38 |
-9.81 |
0.73 |
0 |
|
|
48113 |
10537260 |
1 |
SC14H26 |
AB14C26 |
-42.02 |
1.98 |
-8.48 |
0.53 |
0 |