List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
425843 |
135128270 |
1 |
ON4C13H16 |
AB4C13D16 |
34.14 |
2.51 |
-8.32 |
-0.33 |
0 |
|
|
425844 |
135128278 |
1 |
SO2N6C21H22 |
AB2C6D21E22 |
22.76 |
2.29 |
-8.24 |
-0.8 |
0 |
|
|
425845 |
135128279 |
1 |
NO2C13H27 |
AB2C13D27 |
-128.45 |
3.07 |
-8.82 |
2.04 |
0 |
|
|
425846 |
135128280 |
1 |
O2S2N6C23H24 |
A2B2C6D23E24 |
15.75 |
7.12 |
-8.56 |
-1.06 |
0 |
|
|
425847 |
135128281 |
1 |
O2S2N5C21H27 |
A2B2C5D21E27 |
-22.79 |
6.76 |
-8.37 |
-0.85 |
0 |
|
|
425848 |
135128282 |
1 |
OSN6C25H34 |
ABC6D25E34 |
14.6 |
2.87 |
-8.22 |
-0.72 |
0 |
|
|
425849 |
135128283 |
1 |
N3H35C42 |
A3B35C42 |
175.71 |
3.11 |
-8.1 |
-1.15 |
0 |
|
|
425850 |
135128285 |
1 |
OSN7C23H27 |
ABC7D23E27 |
64.04 |
7.88 |
-8.43 |
-0.92 |
0 |
|
|
425851 |
135128286 |
1 |
OSN6C24H32 |
ABC6D24E32 |
9.66 |
4.16 |
-8.01 |
-0.55 |
0 |
|
|
425852 |
135128287 |
1 |
SN6C24H32 |
AB6C24D32 |
57.24 |
3.39 |
-8.0 |
-0.52 |
0 |
|
|
425853 |
135128288 |
1 |
OS2N6C18H22 |
AB2C6D18E22 |
99.87 |
5.14 |
-8.49 |
-0.9 |
0 |
|
|
425854 |
135128290 |
1 |
SO2N5C21H25 |
AB2C5D21E25 |
-42.94 |
3.61 |
-8.33 |
-0.72 |
0 |
|
|
425855 |
135128294 |
1 |
S2N5C14H15 |
A2B5C14D15 |
93.82 |
5.67 |
-8.5 |
-0.91 |
0 |
|
|
425856 |
135128301 |
1 |
SO2N6C25H32 |
AB2C6D25E32 |
-38.38 |
7.76 |
-8.45 |
-0.82 |
0 |
|
|
425857 |
135128337 |
1 |
O5C23H32 |
A5B23C32 |
-213.07 |
3.67 |
-8.54 |
-0.35 |
0 |
|
|
425858 |
135128353 |
1 |
SN3F9O9H42C44 |
AB3C9D9E42F44 |
-702.6 |
5.72 |
-8.66 |
-1.18 |
0 |
|
|
425859 |
135128360 |
1 |
N3O11C70H91 |
A3B11C70D91 |
-323.67 |
5.34 |
-8.33 |
-0.38 |
0 |
|
|
425860 |
135128361 |
1 |
SN3O10C44H51 |
AB3C10D44E51 |
-309.21 |
4.76 |
-8.64 |
-1.0 |
0 |
|
|
425861 |
135128362 |
1 |
SN5O7C36H39 |
AB5C7D36E39 |
-157.17 |
2.29 |
-8.7 |
-1.38 |
0 |
|
|
425862 |
135128369 |
1 |
SN3O10H45C46 |
AB3C10D45E46 |
-253.2 |
6.01 |
-8.51 |
-1.0 |
0 |
|
|
425863 |
135128374 |
1 |
SN3O9C46H47 |
AB3C9D46E47 |
-218.28 |
3.32 |
-8.4 |
-0.77 |
0 |
|
|
425864 |
135128375 |
1 |
SN3F9O14C67H72 |
AB3C9D14E67F72 |
-904.31 |
4.9 |
-8.6 |
-1.13 |
0 |
|
|
425865 |
135128377 |
1 |
O5C22H26 |
A5B22C26 |
-167.26 |
6.31 |
-9.2 |
-0.65 |
0 |
|
|
425866 |
135128378 |
1 |
S2N4O13C72H84 |
A2B4C13D72E84 |
-412.46 |
5.99 |
-8.44 |
-0.92 |
0 |
|
|
425867 |
135128381 |
6 |
O2C8H11 |
A2B8C11 |
-513.78 |
2.68 |
-8.63 |
-0.31 |
0 |
|
|
425868 |
135128383 |
1 |
O13C33H34 |
A13B33C34 |
-469.78 |
8.84 |
-9.12 |
-1.2 |
0 |
|
|
425869 |
135128385 |
1 |
N3C9H11 |
A3B9C11 |
65.71 |
3.53 |
-8.52 |
-0.07 |
0 |
|
|
425870 |
135128390 |
1 |
O5C24H34 |
A5B24C34 |
-217.46 |
3.7 |
-8.52 |
-0.35 |
0 |
|
|
425871 |
135128457 |
1 |
Cl2N2O3C15H16 |
A2B2C3D15E16 |
-92.77 |
3.86 |
-9.26 |
-0.97 |
0 |
|
|
425872 |
135128532 |
1 |
NF3C10H10 |
AB3C10D10 |
-76.67 |
3.93 |
-8.98 |
0.31 |
0 |
|
|
425874 |
135128627 |
10 |
CFH |
ABC |
-516.3 |
0.3 |
-11.34 |
-0.77 |
0 |
|
|
425875 |
135128728 |
1 |
NOH17C18 |
ABC17D18 |
26.64 |
5.91 |
-8.58 |
-0.46 |
0 |
|
|
425876 |
135128809 |
1 |
N8C17H22 |
A8B17C22 |
96.73 |
0.89 |
-7.82 |
-0.21 |
0 |
|
|
425877 |
135128812 |
1 |
N8C21H28 |
A8B21C28 |
93.37 |
4.53 |
-7.9 |
-0.15 |
0 |
|
|
425878 |
135128813 |
2 |
N4C11H15 |
A4B11C15 |
86.12 |
3.6 |
-7.95 |
-0.15 |
0 |
|
|
425879 |
135128987 |
2 |
NH21C26 |
AB21C26 |
182.03 |
1.34 |
-7.7 |
-0.5 |
0 |
|
|
425880 |
135129001 |
1 |
NOC14H19 |
ABC14D19 |
-43.35 |
4.8 |
-8.54 |
-0.27 |
0 |
|
|
425881 |
135129128 |
1 |
SO2N6C23H26 |
AB2C6D23E26 |
33.01 |
8.83 |
-8.36 |
-0.69 |
0 |
|
|
425882 |
135129155 |
1 |
ON9H15C18 |
AB9C15D18 |
151.81 |
9.87 |
-8.62 |
-0.86 |
0 |
|
|
425883 |
135129250 |
1 |
OSN8C18H20 |
ABC8D18E20 |
100.29 |
10.1 |
-8.35 |
-0.75 |
0 |
|
|
425884 |
135129251 |
1 |
FO2N8C19H21 |
AB2C8D19E21 |
21.51 |
4.33 |
-7.91 |
-0.43 |
0 |
|
|
425885 |
135129264 |
1 |
OSN8C20H24 |
ABC8D20E24 |
90.67 |
7.98 |
-8.25 |
-0.56 |
0 |
|
|
425886 |
135129265 |
1 |
SN8C18H20 |
AB8C18D20 |
144.71 |
10.22 |
-8.23 |
-0.42 |
0 |
|
|
425887 |
135129296 |
1 |
O2S2N7C19H19 |
A2B2C7D19E19 |
52.01 |
10.78 |
-8.24 |
-0.8 |
0 |
|
|
425888 |
135129358 |
1 |
ClSO4N7C38H38 |
ABC4D7E38F38 |
-59.98 |
6.14 |
-8.28 |
-0.95 |
0 |
|
|
425889 |
135129359 |
1 |
N8O9C32H44 |
A8B9C32D44 |
-360.03 |
3.91 |
-8.87 |
-1.47 |
0 |
|
|
425890 |
135129360 |
1 |
ClSN7O8C34H46 |
ABC7D8E34F46 |
-303.43 |
8.58 |
-8.15 |
-1.48 |
0 |
|
|
425891 |
135129473 |
2 |
NH16C22 |
AB16C22 |
314.51 |
1.1 |
-7.66 |
-0.96 |
0 |
|
|
425892 |
135129476 |
1 |
ClFO2N4H22C24 |
ABC2D4E22F24 |
-28.45 |
7.94 |
-8.67 |
-0.84 |
0 |
|
|
425893 |
135129477 |
1 |
O5C22H26 |
A5B22C26 |
-150.45 |
1.02 |
-8.63 |
-0.29 |
0 |
|
|
425894 |
135129478 |
1 |
ClNOF3H15C17 |
ABCD3E15F17 |
-168.09 |
5.27 |
-9.01 |
-1.17 |
0 |
|
|
425895 |
135129479 |
1 |
ClF4N4O5H17C25 |
AB4C4D5E17F25 |
-299.17 |
5.43 |
-9.9 |
-1.75 |
0 |
|
|
425896 |
135129480 |
1 |
NO2C9H17 |
AB2C9D17 |
-109.25 |
5.22 |
-9.32 |
0.2 |
0 |
|
|
425897 |
135129481 |
1 |
NO2C10H21 |
AB2C10D21 |
-118.78 |
3.32 |
-9.3 |
1.55 |
0 |
|
|
425898 |
135129482 |
2 |
N4O8C38H57 |
A4B8C38D57 |
-699.29 |
14.32 |
-9.14 |
-0.63 |
0 |
|
|
425899 |
135129553 |
1 |
PN2O8C24H37 |
AB2C8D24E37 |
-313.21 |
6.66 |
-9.38 |
0.05 |
0 |
|
|
425900 |
135129600 |
1 |
O3N4C8H12 |
A3B4C8D12 |
-65.18 |
2.82 |
-9.9 |
-0.43 |
0 |
|
|
425901 |
135129702 |
1 |
O4N5C24H27 |
A4B5C24D27 |
-50.13 |
4.23 |
-9.35 |
-1.11 |
0 |
|
|
425902 |
135129794 |
1 |
O2N6C21H36 |
A2B6C21D36 |
-82.29 |
2.84 |
-8.52 |
-0.18 |
0 |
|
|
425903 |
135130028 |
1 |
SN2O3C49H58 |
AB2C3D49E58 |
-55.23 |
1.35 |
-8.44 |
-0.64 |
0 |
|
|
425904 |
135130029 |
1 |
BrISO3C20H28 |
ABCD3E20F28 |
-91.04 |
1.61 |
-9.42 |
-1.37 |
0 |
|
|
425905 |
135130116 |
2 |
O5H17C19 |
A5B17C19 |
-287.63 |
0.93 |
-8.7 |
-0.64 |
0 |
|
|
425906 |
135130213 |
1 |
SN6O7C37H56 |
AB6C7D37E56 |
-326.86 |
2.55 |
-8.89 |
-0.57 |
0 |
|
|
425907 |
135130314 |
4 |
OC7H13 |
AB7C13 |
-271.94 |
0.65 |
-10.69 |
-0.28 |
0 |
|
|
425908 |
135130436 |
2 |
O4C5H9 |
A4B5C9 |
-367.94 |
3.76 |
-10.68 |
0.1 |
0 |
|
|
425909 |
135130462 |
1 |
O6C17H30 |
A6B17C30 |
-318.86 |
1.0 |
-9.86 |
0.8 |
0 |
|
|
425910 |
135130650 |
1 |
ON4H24C41 |
AB4C24D41 |
231.18 |
1.32 |
-8.11 |
-1.3 |
0 |
|
|
425911 |
135130762 |
1 |
BrO2N4C24H25 |
AB2C4D24E25 |
58.58 |
4.18 |
-8.4 |
-2.54 |
0 |
|
|
425912 |
135130974 |
2 |
ON3H12C21 |
AB3C12D21 |
241.35 |
0.59 |
-8.09 |
-1.3 |
0 |
|
|
425913 |
135131053 |
1 |
N10H66C69 |
A10B66C69 |
277.03 |
3.44 |
-8.26 |
-1.31 |
0 |
|
|
425914 |
135131082 |
1 |
N3C23H23 |
A3B23C23 |
72.52 |
2.78 |
-7.97 |
-0.31 |
0 |
|
|
425915 |
135131117 |
1 |
N7H47C62 |
A7B47C62 |
293.78 |
7.71 |
-8.11 |
-1.46 |
0 |
|
|
425916 |
135131316 |
1 |
N6H72C79 |
A6B72C79 |
243.34 |
1.39 |
-7.97 |
-1.25 |
0 |
|
|
425917 |
135131482 |
1 |
NSO2C21H21 |
ABC2D21E21 |
-12.77 |
2.33 |
-9.04 |
-0.53 |
0 |
|
|
425918 |
135131495 |
1 |
N3H23C35 |
A3B23C35 |
174.02 |
1.87 |
-8.39 |
-0.7 |
0 |
|
|
425919 |
135131616 |
1 |
FON4H27C31 |
ABC4D27E31 |
62.46 |
6.68 |
-9.24 |
-1.0 |
0 |
|
|
425920 |
135131750 |
1 |
FO2N4H27C29 |
AB2C4D27E29 |
-17.89 |
10.99 |
-9.46 |
-1.31 |
0 |
|
|
425921 |
135131755 |
1 |
O3C17H26 |
A3B17C26 |
-148.53 |
4.43 |
-9.7 |
0.77 |
0 |
|
|
425923 |
135131886 |
1 |
F3O3C19H25 |
A3B3C19D25 |
-299.37 |
5.1 |
-9.57 |
-0.47 |
0 |
|
|
425925 |
135132011 |
1 |
SO7N8C33H34 |
AB7C8D33E34 |
-111.25 |
1.45 |
-9.05 |
-1.35 |
0 |
|
|
425926 |
135132212 |
1 |
ClO2F3N7H15C23 |
AB2C3D7E15F23 |
-36.36 |
6.27 |
-9.83 |
-1.54 |
0 |
|
|
425927 |
135132221 |
1 |
F3O3N4C16H17 |
A3B3C4D16E17 |
-223.25 |
5.13 |
-9.46 |
-1.24 |
0 |
|
|
425928 |
135132391 |
1 |
ClO2F3N7H13C22 |
AB2C3D7E13F22 |
-40.41 |
7.26 |
-9.61 |
-1.82 |
0 |
|
|
425929 |
135132409 |
1 |
S2N10O11C64H72 |
A2B10C11D64E72 |
-255.52 |
9.88 |
-8.17 |
-0.96 |
0 |
|
|
425930 |
135132413 |
1 |
ClF3O3N8H30C34 |
AB3C3D8E30F34 |
-86.43 |
4.84 |
-8.8 |
-1.25 |
0 |
|
|
425931 |
135132417 |
1 |
NP2O9C12H17 |
AB2C9D12E17 |
-496.04 |
5.06 |
-9.99 |
-0.42 |
0 |
|
|
425932 |
135132532 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-61.99 |
3.27 |
-9.06 |
-0.52 |
0 |
|
|
425933 |
135132533 |
3 |
NOC4H7 |
ABC4D7 |
-86.37 |
2.74 |
-9.38 |
-0.5 |
0 |
|
|
425934 |
135132534 |
3 |
NOC4H7 |
ABC4D7 |
-80.05 |
3.87 |
-9.36 |
-0.55 |
0 |
|
|
425935 |
135132657 |
1 |
FNO5C24H28 |
ABC5D24E28 |
-193.29 |
13.5 |
-8.63 |
-0.88 |
0 |
|
|
425936 |
135132658 |
1 |
NO5C25H33 |
AB5C25D33 |
-186.61 |
13.27 |
-8.68 |
-0.57 |
0 |
|
|
425937 |
135132659 |
1 |
O2F3N4H15C28 |
A2B3C4D15E28 |
-13.69 |
5.83 |
-8.56 |
-2.31 |
0 |
|
|
425938 |
135132662 |
1 |
ClFNO4C22H25 |
ABCD4E22F25 |
-189.49 |
9.25 |
-9.13 |
-1.05 |
0 |
|
|
425939 |
135132914 |
1 |
N2O19C53H64 |
A2B19C53D64 |
-776.15 |
1.66 |
-9.42 |
-0.94 |
0 |
|
|
425940 |
135132916 |
2 |
OC8H9 |
AB8C9 |
-21.59 |
5.4 |
-9.26 |
-0.49 |
0 |
|
|
425941 |
135132917 |
1 |
NO4C21H23 |
AB4C21D23 |
-140.73 |
3.32 |
-8.98 |
-0.01 |
0 |
|
|
425942 |
135133162 |
1 |
INO3C11H22 |
ABC3D11E22 |
-163.19 |
2.2 |
-9.7 |
-0.99 |
0 |
|
|
425943 |
135133171 |
1 |
SO4N5C19H21 |
AB4C5D19E21 |
-43.6 |
2.53 |
-8.69 |
-0.34 |
0 |
|
|
425944 |
135133172 |
1 |
NO4C19H37 |
AB4C19D37 |
-265.73 |
0.91 |
-9.97 |
0.81 |
0 |
|
|
425945 |
135133217 |
1 |
F3N10C17H17 |
A3B10C17D17 |
27.14 |
10.39 |
-9.16 |
-1.76 |
0 |