List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
130907 |
51125841 |
1 |
BrSN3O3H16C20 |
ABC3D3E16F20 |
11.8 |
7.44 |
-9.21 |
-1.26 |
0 |
|
|
130908 |
51125999 |
1 |
SO2N4H20C21 |
AB2C4D20E21 |
30.73 |
7.54 |
-9.04 |
-0.74 |
0 |
|
|
130909 |
51126118 |
1 |
BrNSO5H12C14 |
ABCD5E12F14 |
-168.32 |
6.46 |
-9.55 |
-1.52 |
0 |
|
|
130910 |
51126145 |
2 |
NOF2C12H14 |
ABC2D12E14 |
-257.23 |
9.0 |
-8.89 |
-0.73 |
0 |
|
|
130911 |
51126432 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-99.36 |
4.71 |
-8.51 |
0.45 |
0 |
|
|
130912 |
51126835 |
1 |
SO3N4C15H20 |
AB3C4D15E20 |
-92.8 |
3.97 |
-8.39 |
-0.66 |
0 |
|
|
130913 |
51128128 |
1 |
FSN2O4C16H19 |
ABC2D4E16F19 |
-199.9 |
5.99 |
-9.8 |
-0.45 |
0 |
|
|
130914 |
51128414 |
2 |
NO2C10H11 |
AB2C10D11 |
-106.73 |
4.84 |
-8.49 |
-0.09 |
0 |
|
|
130915 |
51128415 |
1 |
N3O3C21H23 |
A3B3C21D23 |
-61.3 |
2.86 |
-8.62 |
-0.53 |
0 |
|
|
130916 |
51128416 |
1 |
FON2C19H23 |
ABC2D19E23 |
-61.29 |
6.92 |
-8.25 |
-0.08 |
0 |
|
|
130917 |
51128519 |
1 |
N2O2F3H13C19 |
A2B2C3D13E19 |
-135.76 |
6.01 |
-9.5 |
-1.47 |
0 |
|
|
130918 |
51128520 |
1 |
SN2O2F3H13C18 |
AB2C2D3E13F18 |
-143.82 |
6.69 |
-9.46 |
-1.41 |
0 |
|
|
130919 |
51128945 |
1 |
ClSN3O3C16H22 |
ABC3D3E16F22 |
-96.22 |
4.06 |
-9.3 |
-1.06 |
0 |
|
|
130920 |
51128946 |
2 |
ON2C10H14 |
AB2C10D14 |
-68.41 |
7.52 |
-8.75 |
-0.83 |
0 |
|
|
130921 |
51129429 |
1 |
N4O4C23H24 |
A4B4C23D24 |
-117.79 |
8.21 |
-8.46 |
-0.51 |
0 |
|
|
130922 |
51129600 |
1 |
O3N4C24H30 |
A3B4C24D30 |
-44.72 |
3.98 |
-9.22 |
-0.18 |
0 |
|
|
130923 |
51129788 |
2 |
N2O2H8C9 |
A2B2C8D9 |
-68.85 |
7.19 |
-9.26 |
-1.16 |
0 |
|
|
130924 |
51129789 |
1 |
BrON3C18H20 |
ABC3D18E20 |
45.11 |
2.06 |
-9.18 |
-0.34 |
0 |
|
|
130925 |
51130048 |
1 |
OSN4C20H22 |
ABC4D20E22 |
62.71 |
5.04 |
-8.88 |
-0.54 |
0 |
|
|
130926 |
51130061 |
1 |
BrN2O2C16H21 |
AB2C2D16E21 |
-46.91 |
2.95 |
-8.93 |
-0.17 |
0 |
|
|
130927 |
51130545 |
1 |
F2N2S2O4H16C17 |
A2B2C2D4E16F17 |
-202.07 |
5.93 |
-8.62 |
-1.51 |
0 |
|
|
130928 |
51130736 |
2 |
ON2C11H13 |
AB2C11D13 |
-7.79 |
7.79 |
-8.81 |
-1.03 |
0 |
|
|
130929 |
51130876 |
2 |
NO2C8H8 |
AB2C8D8 |
-93.4 |
5.16 |
-8.74 |
-1.4 |
0 |
|
|
130930 |
51130877 |
2 |
NO2C9H10 |
AB2C9D10 |
-139.51 |
1.43 |
-8.94 |
-0.6 |
0 |
|
|
130931 |
51130878 |
1 |
N3O5H17C18 |
A3B5C17D18 |
-155.74 |
4.83 |
-8.64 |
-1.41 |
0 |
|
|
130932 |
51130921 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-64.5 |
5.13 |
-9.09 |
-0.06 |
0 |
|
|
130933 |
51131120 |
1 |
O3N4C20H28 |
A3B4C20D28 |
-92.7 |
2.52 |
-8.82 |
-0.25 |
0 |
|
|
130934 |
51131566 |
1 |
ON4C18H22 |
AB4C18D22 |
17.93 |
5.23 |
-9.23 |
-0.32 |
0 |
|
|
130935 |
51132046 |
1 |
ClSN3O4H16C19 |
ABC3D4E16F19 |
-125.85 |
6.66 |
-8.97 |
-1.2 |
0 |
|
|
130936 |
51132047 |
1 |
BrN3O3H20C21 |
AB3C3D20E21 |
-26.58 |
2.92 |
-8.98 |
-0.48 |
0 |
|
|
130937 |
51132230 |
1 |
O2N5H19C20 |
A2B5C19D20 |
44.83 |
2.9 |
-8.62 |
-0.71 |
0 |
|
|
130938 |
51132431 |
1 |
Cl2O2N4H22C23 |
A2B2C4D22E23 |
-28.93 |
4.29 |
-8.74 |
-0.32 |
0 |
|
|
130939 |
51132432 |
1 |
N2O2C19H30 |
A2B2C19D30 |
-118.55 |
7.0 |
-9.01 |
-0.14 |
0 |
|
|
130940 |
51132433 |
1 |
N2O6H26C27 |
A2B6C26D27 |
-173.99 |
6.48 |
-9.21 |
-0.84 |
0 |
|
|
130941 |
51132611 |
1 |
N3O4C19H27 |
A3B4C19D27 |
-165.0 |
5.12 |
-8.68 |
0.01 |
0 |
|
|
130942 |
51132975 |
1 |
O3N5H17C18 |
A3B5C17D18 |
-23.45 |
7.5 |
-9.16 |
-1.13 |
0 |
|
|
130943 |
51133097 |
1 |
N3O4C20H21 |
A3B4C20D21 |
-101.87 |
6.65 |
-8.36 |
-0.46 |
0 |
|
|
130944 |
51133098 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-20.58 |
6.8 |
-9.07 |
-0.34 |
0 |
|
|
130945 |
51133099 |
1 |
FO2N3C20H20 |
AB2C3D20E20 |
-40.09 |
4.46 |
-9.18 |
-0.33 |
0 |
|
|
130946 |
51133113 |
1 |
O2N4H18C19 |
A2B4C18D19 |
3.31 |
2.26 |
-8.48 |
-0.59 |
0 |
|
|
130947 |
51133478 |
1 |
NSO5C16H21 |
ABC5D16E21 |
-180.42 |
5.51 |
-10.21 |
-0.89 |
0 |
|
|
130948 |
51133934 |
1 |
N2O2S2H16C17 |
A2B2C2D16E17 |
0.8 |
3.56 |
-9.08 |
-1.07 |
0 |
|
|
130949 |
51133935 |
1 |
FOSN3H16C18 |
ABCD3E16F18 |
5.73 |
1.95 |
-9.03 |
-0.36 |
0 |
|
|
130950 |
51133993 |
1 |
BrClO2N3C21H25 |
ABC2D3E21F25 |
-69.7 |
5.38 |
-8.95 |
-0.21 |
0 |
|
|
130951 |
51133994 |
1 |
ClON3C17H22 |
ABC3D17E22 |
39.8 |
1.36 |
-9.48 |
-0.38 |
0 |
|
|
130952 |
51134087 |
1 |
FON2C18H19 |
ABC2D18E19 |
-61.29 |
2.61 |
-8.84 |
-0.05 |
0 |
|
|
130953 |
51134443 |
1 |
S2O3N4C21H24 |
A2B3C4D21E24 |
-51.17 |
6.35 |
-8.99 |
-0.99 |
0 |
|
|
130954 |
51134444 |
1 |
FNS2O4H12C16 |
ABC2D4E12F16 |
-113.18 |
4.22 |
-8.65 |
-1.49 |
0 |
|
|
130955 |
51135294 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-133.13 |
6.92 |
-8.37 |
0.05 |
0 |
|
|
130956 |
51135300 |
2 |
NOC10H17 |
ABC10D17 |
-106.27 |
4.49 |
-8.7 |
0.16 |
0 |
|
|
130957 |
51135301 |
2 |
NOC10H13 |
ABC10D13 |
-45.19 |
4.34 |
-8.67 |
-0.39 |
0 |
|
|
130958 |
51135510 |
1 |
OSF3N5C19H22 |
ABC3D5E19F22 |
-112.33 |
6.29 |
-8.92 |
-0.56 |
0 |
|
|
130959 |
51135809 |
1 |
ClN4O5C18H21 |
AB4C5D18E21 |
-151.26 |
5.12 |
-8.92 |
-0.46 |
0 |
|
|
130960 |
51135810 |
1 |
SF2N2O2C22H22 |
AB2C2D2E22F22 |
-106.78 |
4.55 |
-9.32 |
-0.51 |
0 |
|
|
130961 |
51135893 |
1 |
S2N3O4C25H25 |
A2B3C4D25E25 |
-48.09 |
5.69 |
-9.12 |
-1.02 |
0 |
|
|
130962 |
51136310 |
1 |
O3C17H22 |
A3B17C22 |
-109.25 |
3.72 |
-8.91 |
-0.66 |
0 |
|
|
130963 |
51136340 |
1 |
O7C24H34 |
A7B24C34 |
-265.6 |
4.46 |
-9.28 |
-0.59 |
0 |
|
|
130964 |
51136341 |
1 |
ClO7H13C17 |
AB7C13D17 |
-239.89 |
2.38 |
-9.12 |
-1.12 |
0 |
|
|
130965 |
51136342 |
1 |
N3O3H19C24 |
A3B3C19D24 |
-24.79 |
4.77 |
-9.46 |
-1.19 |
0 |
|
|
130966 |
51136343 |
1 |
NO3C13H23 |
AB3C13D23 |
-149.26 |
5.4 |
-9.22 |
-0.26 |
0 |
|
|
130967 |
51136344 |
1 |
NO2C13H23 |
AB2C13D23 |
-104.11 |
6.64 |
-9.37 |
-0.23 |
0 |
|
|
130968 |
51136345 |
1 |
NO3C13H21 |
AB3C13D21 |
-137.62 |
7.21 |
-9.96 |
-0.43 |
0 |
|
|
130969 |
51136346 |
1 |
O6C15H20 |
A6B15C20 |
-231.5 |
9.23 |
-10.17 |
-0.87 |
0 |
|
|
130970 |
51137228 |
1 |
ON3C16H19 |
AB3C16D19 |
47.09 |
3.9 |
-9.14 |
-0.93 |
0 |
|
|
130971 |
51137270 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-9.99 |
3.19 |
-9.06 |
-1.01 |
0 |
|
|
130972 |
51137271 |
1 |
N3O3C18H19 |
A3B3C18D19 |
-8.89 |
4.14 |
-8.82 |
-1.06 |
0 |
|
|
130973 |
51137272 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-9.99 |
4.28 |
-8.98 |
-1.0 |
0 |
|
|
130974 |
51137390 |
1 |
FON3C20H20 |
ABC3D20E20 |
5.13 |
4.06 |
-9.29 |
-0.2 |
0 |
|
|
130975 |
51137473 |
1 |
SO2N3C18H19 |
AB2C3D18E19 |
25.41 |
6.73 |
-9.08 |
-0.82 |
0 |
|
|
130976 |
51137943 |
1 |
OF4N5H13C17 |
AB4C5D13E17 |
-124.63 |
4.53 |
-9.17 |
-1.29 |
0 |
|
|
130977 |
51137944 |
1 |
ON5C14H19 |
AB5C14D19 |
27.91 |
3.64 |
-8.89 |
-0.28 |
0 |
|
|
130978 |
51137945 |
2 |
ON2C10H14 |
AB2C10D14 |
-79.57 |
5.8 |
-8.48 |
-0.17 |
0 |
|
|
130979 |
51138287 |
1 |
SO2F3N4H15C20 |
AB2C3D4E15F20 |
-117.75 |
3.61 |
-9.17 |
-1.52 |
0 |
|
|
130980 |
51138417 |
3 |
NOC5H5 |
ABC5D5 |
-33.65 |
8.16 |
-8.81 |
-0.6 |
0 |
|
|
130981 |
51138619 |
1 |
NO5C21H23 |
AB5C21D23 |
-131.36 |
6.0 |
-8.68 |
-0.43 |
0 |
|
|
130982 |
51138620 |
1 |
O7C21H22 |
A7B21C22 |
-234.19 |
4.7 |
-8.6 |
-0.77 |
0 |
|
|
130983 |
51138621 |
1 |
NO6C21H23 |
AB6C21D23 |
-145.82 |
22.82 |
-7.75 |
-1.48 |
0 |
|
|
130984 |
51138622 |
1 |
NO6C21H23 |
AB6C21D23 |
-169.03 |
2.62 |
-8.09 |
-0.48 |
0 |
|
|
130985 |
51138837 |
1 |
ClN2O2C15H19 |
AB2C2D15E19 |
-94.97 |
2.85 |
-9.44 |
-0.25 |
0 |
|
|
130986 |
51138917 |
1 |
N4O4C19H26 |
A4B4C19D26 |
-168.12 |
5.73 |
-9.01 |
-0.42 |
0 |
|
|
130987 |
51138966 |
1 |
N3O3C21H35 |
A3B3C21D35 |
-182.89 |
1.17 |
-9.4 |
0.29 |
0 |
|
|
130988 |
51139425 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-160.85 |
4.93 |
-9.42 |
-0.6 |
0 |
|
|
130989 |
51139961 |
1 |
NF2O2H15C16 |
AB2C2D15E16 |
-130.94 |
2.76 |
-9.0 |
-0.54 |
0 |
|
|
130990 |
51140190 |
1 |
ON3C15H21 |
AB3C15D21 |
-27.86 |
3.39 |
-9.05 |
-0.27 |
0 |
|
|
130991 |
51140414 |
1 |
NF2O3C17H17 |
AB2C3D17E17 |
-169.96 |
5.41 |
-8.96 |
-0.55 |
0 |
|
|
130992 |
51140526 |
1 |
N3O3S3C15H17 |
A3B3C3D15E17 |
-41.28 |
1.3 |
-8.73 |
-1.14 |
0 |
|
|
130993 |
51140527 |
1 |
ON4S4C13H14 |
AB4C4D13E14 |
36.02 |
2.08 |
-8.64 |
-1.34 |
0 |
|
|
130994 |
51140528 |
1 |
O2N3S3H9C10 |
A2B3C3D9E10 |
79.82 |
5.02 |
-8.87 |
-1.51 |
0 |
|
|
130995 |
51141610 |
1 |
ClSO2N4C14H17 |
ABC2D4E14F17 |
-47.76 |
6.58 |
-9.14 |
-0.86 |
0 |
|
|
130996 |
51141611 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-40.61 |
4.12 |
-8.96 |
-0.91 |
0 |
|
|
130997 |
51141612 |
1 |
ClOS2N3C10H12 |
ABC2D3E10F12 |
10.52 |
3.91 |
-9.05 |
-0.96 |
0 |
|
|
130998 |
51141724 |
1 |
BrFN2O4C15H16 |
ABC2D4E15F16 |
-198.45 |
3.97 |
-9.32 |
-0.84 |
0 |
|
|
130999 |
51141858 |
1 |
ClF2O3N5H12C16 |
AB2C3D5E12F16 |
-101.79 |
7.02 |
-9.44 |
-1.39 |
0 |
|
|
131000 |
51141859 |
1 |
O2N6C15H16 |
A2B6C15D16 |
70.59 |
2.04 |
-9.78 |
-1.44 |
0 |
|
|
131001 |
51142007 |
1 |
SO2N4H16C18 |
AB2C4D16E18 |
50.78 |
5.2 |
-8.65 |
-0.74 |
0 |
|
|
131002 |
51142008 |
1 |
SO3N4H16C19 |
AB3C4D16E19 |
3.92 |
7.6 |
-8.72 |
-1.16 |
0 |
|
|
131003 |
51142197 |
4 |
NOC5H6 |
ABC5D6 |
-89.73 |
4.29 |
-8.41 |
-0.22 |
0 |
|
|
131004 |
51142848 |
1 |
FO2S2N3C18H18 |
AB2C2D3E18F18 |
-32.85 |
6.5 |
-9.03 |
-0.73 |
0 |
|
|
131005 |
51143552 |
1 |
ClN3O4C19H20 |
AB3C4D19E20 |
-47.64 |
7.6 |
-9.32 |
-1.37 |
0 |
|
|
131006 |
51143553 |
1 |
ClN2O3C19H19 |
AB2C3D19E19 |
-79.03 |
2.45 |
-9.43 |
-0.22 |
0 |