List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
404086 |
135064945 |
1 |
NO3C17H21 |
AB3C17D21 |
-98.23 |
4.15 |
-8.28 |
-0.56 |
0 |
|
|
404087 |
135064946 |
1 |
FNO5C19H24 |
ABC5D19E24 |
-272.09 |
6.01 |
-10.1 |
-0.66 |
0 |
|
|
404088 |
135064947 |
1 |
NO3C21H25 |
AB3C21D25 |
-84.45 |
3.52 |
-8.05 |
-0.12 |
0 |
|
|
404089 |
135064948 |
3 |
O2C5H6 |
A2B5C6 |
-261.96 |
2.05 |
-9.68 |
-0.22 |
0 |
|
|
404090 |
135064949 |
1 |
BrO3C14H17 |
AB3C14D17 |
-123.67 |
4.5 |
-10.13 |
-1.25 |
0 |
|
|
404091 |
135064950 |
1 |
FNO2C10H10 |
ABC2D10E10 |
-114.78 |
5.05 |
-10.11 |
-0.59 |
0 |
|
|
404092 |
135064952 |
1 |
NSO3C16H25 |
ABC3D16E25 |
-103.6 |
4.13 |
-9.9 |
-0.46 |
0 |
|
|
404093 |
135064953 |
1 |
NSO4C12H17 |
ABC4D12E17 |
-115.97 |
7.76 |
-9.65 |
-0.45 |
0 |
|
|
404094 |
135064954 |
1 |
BrOF3C12H20 |
ABC3D12E20 |
-249.66 |
5.69 |
-10.4 |
-0.12 |
0 |
|
|
404095 |
135064955 |
1 |
NS2O4H21C22 |
AB2C4D21E22 |
-71.85 |
2.76 |
-9.82 |
-0.86 |
0 |
|
|
404096 |
135064956 |
1 |
O2H12C13 |
A2B12C13 |
-29.61 |
3.67 |
-9.86 |
-0.55 |
0 |
|
|
404097 |
135064959 |
2 |
OC6H8 |
AB6C8 |
-54.64 |
2.77 |
-9.43 |
0.12 |
0 |
|
|
404098 |
135064960 |
1 |
FO2H13C16 |
AB2C13D16 |
-47.78 |
1.79 |
-9.86 |
-0.9 |
0 |
|
|
404099 |
135064961 |
1 |
SN2O5C14H20 |
AB2C5D14E20 |
-110.84 |
4.77 |
-10.1 |
-1.72 |
0 |
|
|
404100 |
135064962 |
1 |
NO4C15H19 |
AB4C15D19 |
-161.01 |
3.46 |
-9.75 |
-0.18 |
0 |
|
|
404101 |
135064964 |
2 |
ON2H5C6 |
AB2C5D6 |
40.42 |
4.0 |
-10.28 |
-0.97 |
0 |
|
|
404102 |
135064965 |
1 |
SO4H14C15 |
AB4C14D15 |
-111.51 |
6.31 |
-9.22 |
-0.89 |
0 |
|
|
404103 |
135064966 |
4 |
OC5H5 |
AB5C5 |
-106.49 |
5.43 |
-9.48 |
-0.76 |
0 |
|
|
404104 |
135064969 |
1 |
SN2O5C19H20 |
AB2C5D19E20 |
-67.27 |
3.48 |
-9.8 |
-1.92 |
0 |
|
|
404105 |
135064970 |
1 |
NO4Cl5H14C20 |
AB4C5D14E20 |
-109.93 |
2.49 |
-9.61 |
-1.3 |
0 |
|
|
404106 |
135064972 |
1 |
SN3O7H23C26 |
AB3C7D23E26 |
-184.92 |
4.16 |
-8.48 |
-0.74 |
0 |
|
|
404107 |
135064974 |
1 |
SiO3C17H34 |
AB3C17D34 |
-218.25 |
2.03 |
-9.86 |
0.43 |
0 |
|
|
404108 |
135064975 |
1 |
SN2O3C16H16 |
AB2C3D16E16 |
-43.96 |
2.01 |
-9.03 |
-0.56 |
0 |
|
|
404109 |
135064976 |
1 |
ClSN2O3H15C16 |
ABC2D3E15F16 |
-54.78 |
2.1 |
-9.08 |
-0.55 |
0 |
|
|
404110 |
135064977 |
1 |
NO2C17H21 |
AB2C17D21 |
-50.54 |
5.57 |
-9.55 |
-0.41 |
0 |
|
|
404111 |
135065000 |
1 |
IPN2O2C17H20 |
ABC2D2E17F20 |
-63.0 |
6.0 |
-9.45 |
-1.43 |
0 |
|
|
404112 |
135065013 |
1 |
PBr2O3H21C23 |
AB2C3D21E23 |
-95.03 |
2.08 |
-9.67 |
-1.02 |
0 |
|
|
404113 |
135065027 |
1 |
N2O3H12C13 |
A2B3C12D13 |
-46.88 |
2.43 |
-8.28 |
-0.75 |
0 |
|
|
404114 |
135065079 |
2 |
NH8C10 |
AB8C10 |
106.16 |
3.38 |
-8.57 |
-0.32 |
0 |
|
|
404115 |
135065081 |
1 |
N2O3H18C20 |
A2B3C18D20 |
-36.69 |
2.76 |
-9.34 |
-0.73 |
0 |
|
|
404116 |
135065082 |
2 |
NC8H10 |
AB8C10 |
38.49 |
2.42 |
-8.79 |
-0.18 |
0 |
|
|
404117 |
135065083 |
1 |
ON2H16C17 |
AB2C16D17 |
48.49 |
4.41 |
-8.67 |
-0.39 |
0 |
|
|
404118 |
135065084 |
1 |
BrN2H13C16 |
AB2C13D16 |
88.3 |
5.23 |
-8.79 |
-0.57 |
0 |
|
|
404119 |
135065085 |
1 |
BrPN2O5C13H14 |
ABC2D5E13F14 |
-192.53 |
4.15 |
-9.48 |
-0.72 |
0 |
|
|
404120 |
135065087 |
1 |
PN2O5C13H15 |
AB2C5D13E15 |
-196.3 |
5.4 |
-9.65 |
-0.59 |
0 |
|
|
404121 |
135065088 |
1 |
SN2O3C15H18 |
AB2C3D15E18 |
-69.92 |
6.66 |
-9.23 |
-0.89 |
0 |
|
|
404122 |
135065089 |
1 |
SN2O3C15H18 |
AB2C3D15E18 |
-70.78 |
4.07 |
-9.29 |
-0.9 |
0 |
|
|
404123 |
135065090 |
1 |
SiN3O3C21H21 |
AB3C3D21E21 |
54.93 |
7.6 |
-8.71 |
-1.28 |
0 |
|
|
404124 |
135065093 |
2 |
N2O2C7H12 |
A2B2C7D12 |
-115.2 |
5.86 |
-8.69 |
-0.89 |
0 |
|
|
404125 |
135065094 |
1 |
N4O4C15H26 |
A4B4C15D26 |
-118.77 |
4.29 |
-8.71 |
-0.93 |
0 |
|
|
404126 |
135065096 |
2 |
NOH11C12 |
ABC11D12 |
31.79 |
3.6 |
-8.33 |
-0.13 |
0 |
|
|
404127 |
135065099 |
1 |
ON2C16H22 |
AB2C16D22 |
24.32 |
3.63 |
-8.33 |
-0.26 |
0 |
|
|
404128 |
135065100 |
1 |
ClN2O2H15C18 |
AB2C2D15E18 |
-8.4 |
0.54 |
-9.23 |
-0.93 |
0 |
|
|
404129 |
135065101 |
1 |
ClN2O2H19C24 |
AB2C2D19E24 |
15.53 |
6.87 |
-9.09 |
-0.69 |
0 |
|
|
404130 |
135065104 |
1 |
N3O4C15H17 |
A3B4C15D17 |
-49.82 |
7.99 |
-9.77 |
-1.44 |
0 |
|
|
404131 |
135065105 |
1 |
N2O2C29H38 |
A2B2C29D38 |
-57.48 |
5.16 |
-8.99 |
-0.2 |
0 |
|
|
404132 |
135065106 |
1 |
N2O2H18C23 |
A2B2C18D23 |
46.28 |
2.41 |
-8.98 |
-0.88 |
0 |
|
|
404133 |
135065107 |
1 |
SN3O3H15C21 |
AB3C3D15E21 |
78.53 |
9.76 |
-9.41 |
-1.64 |
0 |
|
|
404134 |
135065109 |
1 |
PN2O4C14H17 |
AB2C4D14E17 |
-142.0 |
1.29 |
-8.76 |
-0.26 |
0 |
|
|
404135 |
135065112 |
1 |
SN2F3H11C15 |
AB2C3D11E15 |
-69.28 |
6.31 |
-9.15 |
-0.76 |
0 |