List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
336938 |
127255945 |
1 |
ClNO2C20H26 |
ABC2D20E26 |
-103.3 |
4.32 |
-9.06 |
-0.12 |
0 |
|
|
336939 |
127255946 |
1 |
ClNO2C20H26 |
ABC2D20E26 |
-104.96 |
3.63 |
-9.05 |
-0.07 |
0 |
|
|
336940 |
127255947 |
1 |
ClNO2C19H24 |
ABC2D19E24 |
-98.22 |
1.63 |
-9.19 |
-0.17 |
0 |
|
|
336941 |
127255948 |
1 |
NO2C19H23 |
AB2C19D23 |
-60.72 |
1.86 |
-8.87 |
0.08 |
0 |
|
|
336942 |
127255949 |
1 |
ClNO2C21H28 |
ABC2D21E28 |
-110.88 |
3.02 |
-8.75 |
0.18 |
0 |
|
|
336943 |
127255950 |
1 |
NO2C21H27 |
AB2C21D27 |
-76.01 |
2.95 |
-8.82 |
0.1 |
0 |
|
|
336944 |
127255951 |
1 |
NO4C22H23 |
AB4C22D23 |
-154.48 |
8.27 |
-9.31 |
-0.5 |
0 |
|
|
336945 |
127255952 |
1 |
NO5C24H27 |
AB5C24D27 |
-177.29 |
6.13 |
-8.83 |
-0.5 |
0 |
|
|
336946 |
127255953 |
1 |
NO5C24H27 |
AB5C24D27 |
-180.85 |
6.74 |
-9.4 |
-1.06 |
0 |
|
|
336947 |
127255954 |
2 |
ClNOC3H7 |
ABCD3E7 |
-162.3 |
1.67 |
-9.62 |
0.26 |
0 |
|
|
336948 |
127255955 |
1 |
ClNBr2O2H4C7 |
ABC2D2E4F7 |
-51.38 |
3.43 |
-10.16 |
-1.77 |
0 |
|
|
336949 |
127255956 |
1 |
ClON2F3C7H8 |
ABC2D3E7F8 |
-206.45 |
3.24 |
-10.11 |
-1.03 |
0 |
|
|
336950 |
127255957 |
1 |
SP3N5O12C17H22 |
AB3C5D12E17F22 |
-631.44 |
3.17 |
-8.79 |
-0.8 |
0 |
|
|
336951 |
127256106 |
1 |
BrH17C30 |
AB17C30 |
124.56 |
2.0 |
-8.4 |
-1.28 |
0 |
|
|
336952 |
127256107 |
1 |
INC32H32 |
ABC32D32 |
82.67 |
2.61 |
-7.74 |
-0.7 |
0 |
|
|
336953 |
127256108 |
1 |
BrNH20C31 |
ABC20D31 |
140.26 |
1.54 |
-8.3 |
-0.66 |
0 |
|
|
336954 |
127256109 |
1 |
N2O2H40C57 |
A2B2C40D57 |
163.01 |
1.39 |
-7.76 |
-0.59 |
0 |
|
|
336955 |
127256110 |
1 |
N2O3H12C13 |
A2B3C12D13 |
14.13 |
8.5 |
-9.79 |
-1.35 |
0 |
|
|
336956 |
127256111 |
1 |
N2O3H10C12 |
A2B3C10D12 |
20.87 |
6.22 |
-9.6 |
-1.45 |
0 |
|
|
336957 |
127256112 |
1 |
BrN2O3H9C12 |
AB2C3D9E12 |
23.54 |
4.67 |
-9.61 |
-1.55 |
0 |
|
|
336958 |
127256113 |
1 |
Br2N2O2H4C9 |
A2B2C2D4E9 |
-14.31 |
4.17 |
-10.36 |
-2.1 |
0 |
|
|
336959 |
127256114 |
1 |
Br2N2O2H8C11 |
A2B2C2D8E11 |
-23.47 |
5.71 |
-10.07 |
-1.88 |
0 |
|
|
336960 |
127256115 |
1 |
BrN2O2H5C9 |
AB2C2D5E9 |
-18.77 |
5.49 |
-10.48 |
-1.89 |
0 |
|
|
336961 |
127256116 |
1 |
BrN2O2H9C11 |
AB2C2D9E11 |
-27.63 |
6.66 |
-10.11 |
-1.67 |
0 |
|
|
336962 |
127256117 |
1 |
Br2N2O2H4C9 |
A2B2C2D4E9 |
-3.09 |
6.45 |
-10.39 |
-2.19 |
0 |
|
|
336963 |
127256118 |
1 |
BrN2O2H9C11 |
AB2C2D9E11 |
-15.19 |
4.71 |
-10.06 |
-1.53 |
0 |
|
|
336964 |
127256529 |
1 |
SO10N16C40H62 |
AB10C16D40E62 |
-302.45 |
5.51 |
-7.42 |
-0.34 |
0 |
|
|
336965 |
127256530 |
2 |
NOH6C9 |
ABC6D9 |
44.6 |
9.67 |
-7.65 |
-1.58 |
0 |
|
|
336966 |
127256531 |
1 |
NaPSN2O8C9H12 |
ABCD2E8F9G12 |
-406.12 |
22.32 |
-8.88 |
-1.62 |
0 |
|
|
336967 |
127256532 |
1 |
ClNSO5C6H8 |
ABCD5E6F8 |
-203.82 |
1.58 |
-8.55 |
-1.08 |
0 |
|
|
336968 |
127256533 |
1 |
SN3O6C13H17 |
AB3C6D13E17 |
-225.6 |
3.93 |
-9.48 |
-1.76 |
0 |
|
|
336969 |
127256534 |
1 |
OCl4H10C18 |
AB4C10D18 |
-0.02 |
2.58 |
-9.22 |
-0.88 |
0 |
|
|
336970 |
127256535 |
1 |
PNa2N5O7C10H12 |
AB2C5D7E10F12 |
-421.81 |
20.85 |
-9.24 |
-0.43 |
0 |
|
|
336971 |
127256536 |
1 |
PN2Na2O9C13H13 |
AB2C2D9E13F13 |
-522.74 |
5.43 |
-8.61 |
-0.06 |
0 |
|
|
336972 |
127256537 |
1 |
PN2Na2O11C13H15 |
AB2C2D11E13F15 |
-624.73 |
21.23 |
-8.66 |
-1.57 |
0 |
|
|
336973 |
127256538 |
1 |
PN2O11C13H17 |
AB2C11D13E17 |
-524.4 |
4.5 |
-10.61 |
-1.36 |
0 |
|
|
336974 |
127256539 |
1 |
PN2Na2O10C13H15 |
AB2C2D10E13F15 |
-557.36 |
22.49 |
-8.45 |
-1.82 |
0 |
|
|
336975 |
127256540 |
1 |
PN2O10C13H17 |
AB2C10D13E17 |
-462.25 |
5.24 |
-9.35 |
-0.74 |
0 |
|
|
336976 |
127256541 |
1 |
PN2Na2O10C12H15 |
AB2C2D10E12F15 |
-591.88 |
14.38 |
-8.55 |
-0.68 |
0 |
|
|
336977 |
127256542 |
1 |
PN2O10C12H17 |
AB2C10D12E17 |
-485.53 |
5.72 |
-9.78 |
-0.68 |
0 |
|
|
336978 |
127256543 |
1 |
IPN2Na2O10C11H12 |
ABC2D2E10F11G12 |
-596.01 |
4.46 |
-8.75 |
-0.58 |
0 |
|
|
336979 |
127256544 |
1 |
IPN2O10C11H14 |
ABC2D10E11F14 |
-460.52 |
5.17 |
-9.71 |
-1.6 |
0 |
|
|
336980 |
127256545 |
1 |
BrPN2Na2O10C11H12 |
ABC2D2E10F11G12 |
-596.48 |
14.1 |
-8.85 |
-0.64 |
0 |
|
|
336981 |
127256546 |
1 |
BrPN2O10C11H14 |
ABC2D10E11F14 |
-472.13 |
6.78 |
-9.78 |
-0.91 |
0 |
|
|
336982 |
127256547 |
1 |
PN2Na2O9C13H17 |
AB2C2D9E13F17 |
-425.07 |
51.01 |
-7.31 |
-3.03 |
0 |
|
|
336983 |
127256548 |
1 |
PN2Na2O9C13H15 |
AB2C2D9E13F15 |
-559.05 |
12.51 |
-9.27 |
-1.05 |
0 |
|
|
336984 |
127256549 |
1 |
ON2C19H24 |
AB2C19D24 |
21.15 |
1.57 |
-8.61 |
0.24 |
0 |
|
|
336985 |
127256550 |
1 |
SN4O4C19H20 |
AB4C4D19E20 |
-109.82 |
8.83 |
-8.67 |
-1.34 |
0 |
|
|
336986 |
127256551 |
1 |
N3O8H21C22 |
A3B8C21D22 |
-116.44 |
9.19 |
-9.26 |
-1.98 |
0 |
|
|
336987 |
127256552 |
2 |
ClH13C15 |
AB13C15 |
86.76 |
3.45 |
-9.38 |
0.0 |
0 |