List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
31926 |
3723586 |
1 |
ClFNH3C7 |
ABCD3E7 |
2.15 |
4.17 |
-10.13 |
-1.3 |
0 |
|
|
31927 |
3723592 |
1 |
FNSO4C12H14 |
ABCD4E12F14 |
-178.95 |
2.61 |
-10.06 |
-0.86 |
0 |
|
|
31928 |
3723602 |
1 |
OCl2N2C17H18 |
AB2C2D17E18 |
-17.61 |
3.6 |
-8.24 |
-1.0 |
0 |
|
|
31929 |
3723613 |
1 |
OSN2F3H11C13 |
ABC2D3E11F13 |
-157.78 |
4.59 |
-9.14 |
-1.39 |
0 |
|
|
31930 |
3723615 |
1 |
FSN2O3H17C25 |
ABC2D3E17F25 |
-47.32 |
8.59 |
-8.76 |
-1.19 |
0 |
|
|
31931 |
3723874 |
1 |
N2O2C27H28 |
A2B2C27D28 |
-38.56 |
5.39 |
-8.0 |
-0.29 |
0 |
|
|
31932 |
3724042 |
1 |
NO2C14H15 |
AB2C14D15 |
-54.91 |
7.72 |
-8.8 |
0.07 |
1 |
|
|
31933 |
3724222 |
1 |
N2C30H31 |
A2B30C31 |
90.81 |
4.08 |
0.0 |
0.0 |
0 |
|
|
31934 |
3724223 |
1 |
OS2H12C17 |
AB2C12D17 |
37.02 |
4.98 |
-8.55 |
-1.05 |
0 |
|
|
31935 |
3724224 |
1 |
BrN2O2C15H15 |
AB2C2D15E15 |
-32.69 |
1.52 |
-9.57 |
-0.35 |
0 |
|
|
31936 |
3724242 |
1 |
N3O4C26H29 |
A3B4C26D29 |
-105.07 |
3.54 |
-8.41 |
-0.18 |
0 |
|
|
31937 |
3724265 |
1 |
ON2C14H22 |
AB2C14D22 |
-15.15 |
5.38 |
-9.28 |
0.55 |
0 |
|
|
31938 |
3724266 |
1 |
NSO3C22H33 |
ABC3D22E33 |
-174.54 |
1.66 |
-8.43 |
-0.54 |
0 |
|
|
31939 |
3724267 |
1 |
NOC19H23 |
ABC19D23 |
-20.77 |
3.58 |
-9.34 |
0.24 |
0 |
|
|
31940 |
3724270 |
1 |
N2O3H16C23 |
A2B3C16D23 |
68.07 |
0.93 |
-9.24 |
-1.8 |
0 |
|
|
31941 |
3724271 |
1 |
OCl2N5H13C20 |
AB2C5D13E20 |
94.99 |
9.45 |
-8.9 |
-1.67 |
0 |
|
|
31942 |
3724278 |
1 |
N4O5C12H18 |
A4B5C12D18 |
-97.25 |
6.73 |
-8.75 |
-1.5 |
0 |
|
|
31943 |
3724289 |
1 |
NCl2O2H15C18 |
AB2C2D15E18 |
-34.99 |
3.59 |
-8.61 |
-0.74 |
0 |
|
|
31944 |
3724297 |
1 |
FO2N3C24H24 |
AB2C3D24E24 |
-84.2 |
9.97 |
-8.61 |
-0.67 |
0 |
|
|
31945 |
3724300 |
1 |
Cl2O2N3H15C23 |
A2B2C3D15E23 |
40.45 |
7.96 |
-9.11 |
-1.15 |
0 |
|
|
31946 |
3724304 |
1 |
ON7C25H29 |
AB7C25D29 |
62.9 |
5.91 |
-9.47 |
-1.24 |
0 |
|
|
31947 |
3724306 |
1 |
ON8H20C23 |
AB8C20D23 |
142.3 |
5.06 |
-9.57 |
-1.35 |
0 |
|
|
31948 |
3724309 |
1 |
ON6C23H24 |
AB6C23D24 |
87.5 |
3.5 |
-9.43 |
-1.16 |
0 |
|
|
31949 |
3724331 |
1 |
N3O4C26H27 |
A3B4C26D27 |
-84.62 |
3.04 |
-8.67 |
-0.38 |
0 |
|
|
31950 |
3724341 |
1 |
N2O2C19H24 |
A2B2C19D24 |
-69.79 |
3.07 |
-8.33 |
0.17 |
0 |
|
|
31951 |
3724742 |
1 |
FSN4O4H19C27 |
ABC4D4E19F27 |
-21.49 |
6.05 |
-8.34 |
-2.11 |
0 |
|
|
31952 |
3724785 |
1 |
SN2O4H22C23 |
AB2C4D22E23 |
-83.32 |
1.07 |
-8.96 |
-1.1 |
0 |
|
|
31953 |
3724791 |
1 |
O3N4H14C15 |
A3B4C14D15 |
-50.89 |
2.43 |
-9.13 |
-1.1 |
0 |
|
|
31954 |
3724908 |
1 |
BrSN2C9H9 |
ABC2D9E9 |
32.97 |
2.44 |
-8.83 |
-0.66 |
0 |
|
|
31955 |
3725216 |
2 |
NO2H15C17 |
AB2C15D17 |
-45.54 |
9.12 |
-8.51 |
-0.4 |
0 |
|
|
31956 |
3725302 |
1 |
NPO4C22H40 |
ABC4D22E40 |
-269.16 |
4.79 |
-8.44 |
0.48 |
0 |
|
|
31957 |
3725303 |
1 |
SN3O3C15H19 |
AB3C3D15E19 |
-98.87 |
5.33 |
-9.64 |
-1.09 |
0 |
|
|
31958 |
3725304 |
1 |
NC20H31 |
AB20C31 |
-51.4 |
1.32 |
-8.5 |
3.1 |
0 |
|
|
31959 |
3725305 |
1 |
NO2C12H19 |
AB2C12D19 |
-122.75 |
3.22 |
-10.08 |
0.88 |
0 |
|
|
31960 |
3725306 |
1 |
NCl2C18H23 |
AB2C18D23 |
-29.11 |
2.56 |
-9.28 |
-0.37 |
0 |
|
|
31961 |
3725635 |
1 |
SF2N4O4C24H30 |
AB2C4D4E24F30 |
-187.02 |
5.04 |
-8.52 |
-0.5 |
0 |
|
|
31962 |
3725636 |
1 |
OS2N4C22H28 |
AB2C4D22E28 |
15.49 |
5.73 |
-8.5 |
-0.49 |
0 |
|
|
31963 |
3725656 |
1 |
ClON2H23C25 |
ABC2D23E25 |
30.62 |
2.35 |
-8.85 |
-1.07 |
0 |
|
|
31964 |
3725688 |
1 |
BrSO2N4H23C25 |
ABC2D4E23F25 |
33.86 |
3.89 |
-8.76 |
-0.56 |
0 |
|
|
31965 |
3725848 |
1 |
N3O5H27C30 |
A3B5C27D30 |
-99.74 |
2.87 |
-8.45 |
-0.25 |
0 |
|
|
31966 |
3725903 |
1 |
BrSN3H10C13 |
ABC3D10E13 |
91.6 |
4.47 |
-8.95 |
-0.76 |
0 |
|
|
31967 |
3725944 |
1 |
SO2N3C23H23 |
AB2C3D23E23 |
-4.94 |
4.07 |
-8.64 |
-0.58 |
0 |
|
|
31968 |
3726011 |
1 |
BrNO3C20H20 |
ABC3D20E20 |
-98.42 |
2.44 |
-8.94 |
-0.63 |
0 |
|
|
31969 |
3726039 |
2 |
O3N4H8C9 |
A3B4C8D9 |
-139.92 |
5.72 |
-9.19 |
-1.96 |
0 |
|
|
31970 |
3726094 |
1 |
ClO2N3C17H20 |
AB2C3D17E20 |
-25.12 |
4.68 |
-9.46 |
-0.76 |
0 |
|
|
31971 |
3726099 |
1 |
BrNO2H18C23 |
ABC2D18E23 |
45.83 |
2.92 |
-8.69 |
-0.89 |
0 |
|
|
31972 |
3726119 |
1 |
ClSN2C17H17 |
ABC2D17E17 |
35.51 |
3.57 |
-8.5 |
-0.28 |
0 |
|
|
31973 |
3726120 |
1 |
SCl2N2H16C17 |
AB2C2D16E17 |
29.04 |
4.7 |
-8.63 |
-0.73 |
0 |
|
|
31974 |
3726532 |
1 |
BrON2F3C20H22 |
ABC2D3E20F22 |
-149.56 |
7.71 |
-8.96 |
-0.51 |
0 |
|
|
31975 |
3726536 |
2 |
NC8H13 |
AB8C13 |
0.86 |
2.18 |
-8.71 |
0.47 |
0 |
|
|
31976 |
3726537 |
2 |
NC7H11 |
AB7C11 |
11.5 |
2.4 |
-8.71 |
0.44 |
0 |
|
|
31977 |
3726648 |
1 |
PSO3C5H7 |
ABC3D5E7 |
-164.15 |
1.12 |
-9.2 |
-0.27 |
0 |
|
|
31978 |
3726649 |
3 |
NOC9H11 |
ABC9D11 |
-81.46 |
6.81 |
-9.05 |
-0.05 |
0 |
|
|
31979 |
3726729 |
1 |
S2N3O6C16H17 |
A2B3C6D16E17 |
-107.63 |
8.25 |
-8.94 |
-1.87 |
0 |
|
|
31980 |
3726978 |
1 |
N4O5C22H34 |
A4B5C22D34 |
-223.76 |
5.67 |
-9.14 |
-0.44 |
0 |
|
|
31981 |
3726979 |
1 |
O3N6C27H28 |
A3B6C27D28 |
0.22 |
7.84 |
-9.03 |
-0.92 |
0 |
|
|
31982 |
3727027 |
1 |
SCl2N2O3H14C17 |
AB2C2D3E14F17 |
-63.01 |
5.75 |
-9.32 |
-1.41 |
0 |
|
|
31983 |
3727028 |
1 |
SN2O3C18H24 |
AB2C3D18E24 |
-101.94 |
10.12 |
-9.08 |
-0.78 |
0 |
|
|
31984 |
3727031 |
1 |
N3O4C38H57 |
A3B4C38D57 |
-165.22 |
5.55 |
-8.36 |
0.02 |
0 |
|
|
31985 |
3727032 |
1 |
NS2O5H15C21 |
AB2C5D15E21 |
-130.56 |
3.43 |
-9.11 |
-1.1 |
0 |
|
|
31986 |
3727037 |
1 |
NO6C27H31 |
AB6C27D31 |
-226.94 |
5.11 |
-9.65 |
-1.03 |
0 |
|
|
31987 |
3727038 |
1 |
NO5H21C22 |
AB5C21D22 |
-149.51 |
3.82 |
-9.39 |
-1.06 |
0 |
|
|
31988 |
3727048 |
1 |
N3O3C20H23 |
A3B3C20D23 |
-34.56 |
3.48 |
-8.5 |
-0.99 |
0 |
|
|
31989 |
3727064 |
1 |
NO7C20H21 |
AB7C20D21 |
-199.93 |
6.31 |
-9.12 |
-1.26 |
0 |
|
|
31990 |
3727070 |
1 |
FO4N5H16C19 |
AB4C5D16E19 |
-129.74 |
5.29 |
-9.21 |
-0.81 |
0 |
|
|
31991 |
3727071 |
1 |
SN3O4H15C20 |
AB3C4D15E20 |
-19.02 |
3.07 |
-8.78 |
-1.52 |
0 |
|
|
31992 |
3727072 |
1 |
N4O7C20H20 |
A4B7C20D20 |
-101.65 |
4.97 |
-8.72 |
-1.37 |
0 |
|
|
31993 |
3727078 |
1 |
N2O7C22H26 |
A2B7C22D26 |
-288.99 |
6.17 |
-10.3 |
-0.96 |
0 |
|
|
31994 |
3727080 |
1 |
ClN2O7H21C23 |
AB2C7D21E23 |
-258.83 |
2.45 |
-9.44 |
-1.05 |
0 |
|
|
31995 |
3727081 |
1 |
N2O7C20H24 |
A2B7C20D24 |
-293.26 |
3.56 |
-10.33 |
-0.96 |
0 |
|
|
31996 |
3727082 |
1 |
N2O5H20C22 |
A2B5C20D22 |
-148.95 |
1.49 |
-9.43 |
-0.62 |
0 |
|
|
31997 |
3727083 |
1 |
N2O5H28C30 |
A2B5C28D30 |
-134.98 |
3.72 |
-9.18 |
-0.6 |
0 |
|
|
31998 |
3727085 |
1 |
N2O5C26H28 |
A2B5C26D28 |
-167.27 |
3.72 |
-9.02 |
-0.7 |
0 |
|
|
31999 |
3727087 |
1 |
N3O7H23C28 |
A3B7C23D28 |
-122.54 |
6.55 |
-9.23 |
-1.61 |
0 |
|
|
32000 |
3727089 |
1 |
ClO3N4C30H31 |
AB3C4D30E31 |
-58.2 |
6.8 |
-9.14 |
-0.76 |
0 |
|
|
32001 |
3727094 |
1 |
SN2O2F6C20H20 |
AB2C2D6E20F20 |
-353.96 |
2.93 |
-9.06 |
-1.63 |
0 |
|
|
32002 |
3727099 |
1 |
N3O5C25H27 |
A3B5C25D27 |
-105.31 |
13.16 |
-9.2 |
-0.74 |
0 |
|
|
32003 |
3892009 |
1 |
BrN3O4C28H30 |
AB3C4D28E30 |
-83.83 |
5.29 |
-8.61 |
-0.71 |
0 |
|
|
32004 |
3897811 |
1 |
SN3O5H17C20 |
AB3C5D17E20 |
-120.16 |
4.99 |
-8.57 |
-2.15 |
0 |
|
|
32005 |
3903783 |
1 |
N2Cl3H15C21 |
A2B3C15D21 |
77.3 |
4.96 |
-8.56 |
-1.02 |
0 |
|
|
32006 |
3965914 |
1 |
N2O5H16C18 |
A2B5C16D18 |
-166.5 |
3.85 |
-8.94 |
-0.85 |
0 |
|
|
32007 |
4222164 |
1 |
O4N9C17H23 |
A4B9C17D23 |
58.7 |
8.65 |
-9.25 |
-1.32 |
0 |
|
|
32008 |
4241326 |
1 |
N2O3C18H20 |
A2B3C18D20 |
-87.05 |
1.35 |
-8.71 |
-0.41 |
0 |
|
|
32009 |
4242284 |
2 |
BrNC9H9 |
ABC9D9 |
49.03 |
2.21 |
-8.64 |
-0.63 |
0 |
|
|
32010 |
4242627 |
1 |
N5O8H15C22 |
A5B8C15D22 |
-10.22 |
5.87 |
-10.07 |
-2.43 |
0 |
|
|
32011 |
4243530 |
1 |
N2O4H10C13 |
A2B4C10D13 |
-13.4 |
7.02 |
-9.77 |
-2.05 |
0 |
|
|
32012 |
4244126 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-46.39 |
4.48 |
-8.47 |
-0.12 |
0 |
|
|
32013 |
4247098 |
1 |
N4O8H16C19 |
A4B8C16D19 |
-96.74 |
4.69 |
-10.49 |
-1.74 |
0 |
|
|
32014 |
4251949 |
1 |
SO2N3C20H23 |
AB2C3D20E23 |
-61.71 |
3.14 |
-8.46 |
-0.72 |
0 |
|
|
32015 |
4252010 |
1 |
SN3O3H17C21 |
AB3C3D17E21 |
64.96 |
6.12 |
-9.1 |
-1.35 |
0 |
|
|
32016 |
4252482 |
1 |
NH19C21 |
AB19C21 |
74.76 |
3.09 |
-8.7 |
-0.32 |
0 |
|
|
32017 |
4252616 |
1 |
SO3N4C27H36 |
AB3C4D27E36 |
-113.5 |
2.27 |
-8.81 |
-0.3 |
0 |
|
|
32018 |
4252750 |
1 |
ClOSN2H17C20 |
ABCD2E17F20 |
36.85 |
3.33 |
-8.87 |
-0.74 |
0 |
|
|
32019 |
4252998 |
1 |
NO4C22H27 |
AB4C22D27 |
-151.0 |
4.21 |
-8.56 |
-0.41 |
0 |
|
|
32020 |
4253034 |
1 |
FN3H16C18 |
AB3C16D18 |
30.88 |
2.43 |
-9.04 |
-0.37 |
0 |
|
|
32021 |
4253155 |
1 |
ClN2O4C25H25 |
AB2C4D25E25 |
-112.28 |
6.26 |
-8.58 |
-0.51 |
0 |
|
|
32022 |
4253279 |
1 |
ClNSO3C14H20 |
ABCD3E14F20 |
-162.24 |
2.27 |
-8.59 |
-0.59 |
0 |
|
|
32023 |
4253323 |
1 |
S2N4O5C28H34 |
A2B4C5D28E34 |
-153.96 |
7.5 |
-9.16 |
-1.86 |
0 |
|
|
32024 |
4253364 |
1 |
NO6C48H69 |
AB6C48D69 |
-269.34 |
2.39 |
-9.45 |
-0.75 |
0 |
|
|
32025 |
4253378 |
1 |
ClN3O3C16H18 |
AB3C3D16E18 |
-56.87 |
4.35 |
-9.68 |
-0.5 |
0 |