List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
388058 |
134987995 |
1 |
NO2C10H19 |
AB2C10D19 |
-109.87 |
3.15 |
-9.74 |
0.59 |
0 |
|
|
388059 |
134987997 |
1 |
NO3C8H15 |
AB3C8D15 |
-112.52 |
3.26 |
-9.37 |
0.47 |
0 |
|
|
388060 |
134988006 |
1 |
OSiC2H3Cl5 |
ABC2D3E5 |
-176.42 |
2.12 |
-11.31 |
-0.89 |
0 |
|
|
388061 |
134988007 |
1 |
NOSiC13H27 |
ABCD13E27 |
-93.87 |
2.27 |
-8.95 |
1.13 |
0 |
|
|
388062 |
134988008 |
1 |
BrO3C10H17 |
AB3C10D17 |
-169.68 |
5.36 |
-10.51 |
-0.65 |
0 |
|
|
388063 |
134988013 |
1 |
NOC7H9 |
ABC7D9 |
-5.59 |
3.96 |
-9.45 |
0.14 |
0 |
|
|
388064 |
134988020 |
1 |
O2C13H16 |
A2B13C16 |
-72.1 |
1.35 |
-9.45 |
0.35 |
0 |
|
|
388065 |
134988033 |
1 |
NOSC9H15 |
ABCD9E15 |
-37.97 |
5.32 |
-9.57 |
-0.51 |
0 |
|
|
388066 |
134988034 |
1 |
BrNO3C8H12 |
ABC3D8E12 |
-135.81 |
4.21 |
-10.33 |
-0.87 |
0 |
|
|
388067 |
134988036 |
1 |
NO3C9H17 |
AB3C9D17 |
-145.24 |
4.96 |
-9.44 |
0.61 |
0 |
|
|
388068 |
134988041 |
1 |
NO2C12H21 |
AB2C12D21 |
-103.38 |
3.61 |
-11.07 |
0.64 |
0 |
|
|
388069 |
134988044 |
2 |
HC3Cl3 |
AB3C3 |
2.53 |
2.2 |
-10.06 |
-1.48 |
0 |
|
|
388070 |
134988049 |
2 |
OSC7H10 |
ABC7D10 |
-80.51 |
3.92 |
-8.56 |
-0.77 |
0 |
|
|
388071 |
134988051 |
1 |
NO3C12H17 |
AB3C12D17 |
-118.46 |
3.34 |
-9.56 |
0.07 |
0 |
|
|
388072 |
134988057 |
1 |
OSN3C10H11 |
ABC3D10E11 |
42.26 |
6.18 |
-8.77 |
-1.58 |
0 |
|
|
388073 |
134988066 |
1 |
BrO3C8H15 |
AB3C8D15 |
-165.65 |
6.04 |
-10.79 |
-0.83 |
0 |
|
|
388074 |
134988074 |
1 |
O3C11H20 |
A3B11C20 |
-164.69 |
2.73 |
-9.83 |
0.74 |
0 |
|
|
388075 |
134988075 |
1 |
IH2O2C5F7 |
AB2C2D5E7 |
-417.25 |
3.07 |
-10.38 |
-2.07 |
0 |
|
|
388076 |
134988076 |
1 |
NO3C9H17 |
AB3C9D17 |
-147.37 |
3.32 |
-9.71 |
0.71 |
0 |
|
|
388077 |
134988078 |
1 |
N2O4C9H16 |
A2B4C9D16 |
-178.12 |
6.56 |
-9.57 |
-0.26 |
0 |
|
|
388078 |
134988082 |
1 |
O2C11H18 |
A2B11C18 |
-100.78 |
2.15 |
-10.12 |
0.94 |
0 |
|
|
388079 |
134988085 |
1 |
Na2O4C7H10 |
A2B4C7D10 |
-249.24 |
0.07 |
-7.04 |
0.97 |
0 |
|
|
388080 |
134988089 |
1 |
OC7H8 |
AB7C8 |
-3.86 |
3.09 |
-9.56 |
0.59 |
0 |
|
|
388081 |
134988090 |
1 |
BrClC6H8 |
ABC6D8 |
19.29 |
2.93 |
-9.74 |
-0.76 |
0 |
|
|
388082 |
134988100 |
1 |
NS3C6H11 |
AB3C6D11 |
31.68 |
4.28 |
-8.44 |
-1.49 |
0 |
|
|
388083 |
134988102 |
1 |
NC12H15 |
AB12C15 |
26.86 |
3.58 |
-9.6 |
0.14 |
0 |
|
|
388084 |
134988106 |
1 |
NSCl2C11H11 |
ABC2D11E11 |
25.5 |
5.61 |
-9.28 |
-0.96 |
0 |
|
|
388085 |
134988108 |
2 |
OC6H10 |
AB6C10 |
-110.67 |
2.46 |
-9.32 |
0.98 |
0 |
|
|
388086 |
134988111 |
1 |
NO4C13H17 |
AB4C13D17 |
-165.69 |
3.81 |
-9.7 |
-0.14 |
0 |
|
|
388087 |
134988125 |
1 |
NO2C9H17 |
AB2C9D17 |
-121.89 |
3.58 |
-9.68 |
1.06 |
0 |
|
|
388088 |
134988126 |
1 |
NO4C12H21 |
AB4C12D21 |
-204.84 |
4.57 |
-9.56 |
0.62 |
0 |
|
|
388089 |
134988127 |
1 |
BrO3C9H17 |
AB3C9D17 |
-167.79 |
3.76 |
-10.67 |
-0.75 |
0 |
|
|
388090 |
134988128 |
1 |
CClHINO |
ABCDEF |
21.1 |
1.05 |
-10.13 |
-1.87 |
0 |
|
|
388091 |
134988147 |
2 |
OC8H15 |
AB8C15 |
-144.47 |
2.42 |
-9.55 |
0.91 |
0 |
|
|
388092 |
134988148 |
1 |
NOSCl2C10H17 |
ABCD2E10F17 |
-77.09 |
3.45 |
-8.79 |
-0.33 |
0 |
|
|
388093 |
134988151 |
1 |
SeN2C15H28 |
AB2C15D28 |
3.98 |
1.84 |
-8.3 |
-0.31 |
0 |
|
|
388094 |
134988153 |
1 |
NO2C13H13 |
AB2C13D13 |
-23.98 |
5.92 |
-8.94 |
-0.4 |
0 |
|
|
388095 |
134988158 |
1 |
NO3C14H17 |
AB3C14D17 |
-89.7 |
1.51 |
-9.15 |
-0.68 |
0 |
|
|
388096 |
134988160 |
1 |
O2C11H18 |
A2B11C18 |
-105.49 |
4.89 |
-9.7 |
0.69 |
0 |
|
|
388097 |
134988161 |
1 |
O2C11H18 |
A2B11C18 |
-93.51 |
4.86 |
-9.62 |
0.66 |
0 |
|
|
388098 |
134988165 |
1 |
NOC11H19 |
ABC11D19 |
-63.4 |
1.2 |
-9.74 |
1.13 |
0 |
|
|
388099 |
134988166 |
1 |
BrNOC12H12 |
ABCD12E12 |
17.63 |
2.48 |
-8.99 |
-0.36 |
0 |
|
|
388100 |
134988167 |
1 |
ClNSO3H6C7 |
ABCD3E6F7 |
-15.25 |
5.88 |
-9.43 |
-1.28 |
0 |
|
|
388101 |
134988168 |
1 |
NSCl2H3O3C7 |
ABC2D3E3F7 |
0.53 |
2.48 |
-9.89 |
-2.12 |
0 |
|
|
388102 |
134988170 |
1 |
Se2O3C5H8 |
A2B3C5D8 |
-107.56 |
5.28 |
-8.67 |
-1.42 |
0 |
|
|
388103 |
134988173 |
2 |
ON2C4H6 |
AB2C4D6 |
-13.15 |
5.72 |
-10.88 |
-0.41 |
0 |
|
|
388104 |
134988176 |
1 |
O2C9H16 |
A2B9C16 |
-92.94 |
1.94 |
-10.44 |
0.88 |
0 |
|
|
388105 |
134988177 |
1 |
O3C13H26 |
A3B13C26 |
-186.7 |
2.87 |
-9.79 |
0.99 |
0 |
|
|
388106 |
134988178 |
1 |
O4C11H20 |
A4B11C20 |
-216.34 |
2.15 |
-10.88 |
0.79 |
0 |
|
|
388107 |
134988184 |
1 |
NOH9C13 |
ABC9D13 |
70.94 |
4.14 |
-8.9 |
-1.25 |
0 |
|
|
388108 |
134988185 |
1 |
Cl2N2O2C11H18 |
A2B2C2D11E18 |
-105.16 |
4.44 |
-9.08 |
-0.57 |
0 |
|
|
388109 |
134988186 |
1 |
NOH11C15 |
ABC11D15 |
55.88 |
2.74 |
-8.66 |
-1.17 |
0 |
|
|
388110 |
134988187 |
1 |
ClNOSC11H14 |
ABCDE11F14 |
-37.27 |
1.92 |
-8.92 |
-0.17 |
0 |
|
|
388111 |
134988188 |
1 |
NO4C7H13 |
AB4C7D13 |
-178.89 |
2.31 |
-9.62 |
0.2 |
0 |
|
|
388112 |
134988190 |
1 |
NO2C13H17 |
AB2C13D17 |
-74.65 |
5.33 |
-8.93 |
0.34 |
0 |
|
|
388113 |
134988193 |
1 |
NO2C15H29 |
AB2C15D29 |
-144.61 |
2.55 |
-9.88 |
1.17 |
0 |
|
|
388114 |
134988197 |
1 |
IO2C11H21 |
AB2C11D21 |
-121.33 |
6.29 |
-9.7 |
-0.81 |
0 |
|
|
388115 |
134988199 |
1 |
O3C13H14 |
A3B13C14 |
-59.22 |
5.68 |
-9.04 |
-0.22 |
0 |
|
|
388116 |
134988203 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-72.34 |
3.02 |
-9.13 |
0.42 |
0 |
|
|
388117 |
134988205 |
1 |
ClNSC6H6 |
ABCD6E6 |
58.51 |
4.76 |
-8.96 |
-0.73 |
0 |
|
|
388118 |
134988224 |
1 |
ClNOSC10H12 |
ABCDE10F12 |
-41.21 |
4.14 |
-9.27 |
-0.72 |
0 |
|
|
388119 |
134988225 |
1 |
SO2C11H14 |
AB2C11D14 |
-62.92 |
2.22 |
-9.24 |
-0.49 |
0 |
|
|
388120 |
134988227 |
2 |
ON4H15C19 |
AB4C15D19 |
380.52 |
6.98 |
-7.87 |
-2.15 |
0 |
|
|
388121 |
134988233 |
1 |
O2C13H24 |
A2B13C24 |
-133.44 |
4.55 |
-10.46 |
0.78 |
0 |
|
|
388122 |
134988242 |
1 |
O2C13H22 |
A2B13C22 |
-94.89 |
1.46 |
-10.09 |
1.02 |
0 |
|
|
388123 |
134988243 |
2 |
OC7H9 |
AB7C9 |
-74.26 |
1.9 |
-9.48 |
0.27 |
0 |
|
|
388124 |
134988252 |
1 |
NOSCl2C12H13 |
ABCD2E12F13 |
-4.57 |
4.06 |
-9.43 |
-0.54 |
0 |
|
|
388125 |
134988258 |
1 |
NC3H3S3 |
AB3C3D3 |
76.91 |
4.55 |
-9.25 |
-1.76 |
0 |
|
|
388126 |
134988262 |
1 |
NO5C9H13 |
AB5C9D13 |
-209.42 |
5.22 |
-10.69 |
-0.25 |
0 |
|
|
388127 |
134988272 |
1 |
CuLiNO2C10H15 |
ABCD2E10F15 |
0.96 |
9.22 |
-7.55 |
0.8 |
0 |
|
|
388128 |
134988276 |
1 |
NOC17H25 |
ABC17D25 |
-32.31 |
4.13 |
-9.21 |
0.32 |
0 |
|
|
388129 |
134988277 |
1 |
BrNOC12H20 |
ABCD12E20 |
-73.75 |
3.87 |
-9.23 |
-0.17 |
0 |
|
|
388130 |
134988279 |
1 |
INOC13H16 |
ABCD13E16 |
-16.87 |
3.89 |
-9.41 |
-1.33 |
0 |
|
|
388131 |
134988286 |
1 |
IO2C9H17 |
AB2C9D17 |
-109.42 |
4.3 |
-10.06 |
-1.12 |
0 |
|
|
388132 |
134988287 |
1 |
O3C13H18 |
A3B13C18 |
-122.25 |
1.93 |
-9.31 |
0.24 |
0 |