List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
212245 |
81059927 |
1 |
ClSN3C16H18 |
ABC3D16E18 |
27.55 |
4.45 |
-8.59 |
-0.46 |
0 |
|
|
212246 |
81059928 |
1 |
ClSN3C16H18 |
ABC3D16E18 |
26.29 |
5.03 |
-8.72 |
-0.53 |
0 |
|
|
212247 |
81059930 |
1 |
SN3C17H21 |
AB3C17D21 |
28.9 |
4.25 |
-8.57 |
-0.43 |
0 |
|
|
212248 |
81059931 |
1 |
ClON2H15C16 |
ABC2D15E16 |
7.61 |
3.88 |
-9.51 |
-0.74 |
0 |
|
|
212249 |
81059932 |
1 |
ON2C16H16 |
AB2C16D16 |
16.89 |
1.96 |
-9.22 |
-0.64 |
0 |
|
|
212250 |
81059933 |
1 |
BrON2H11C14 |
ABC2D11E14 |
39.55 |
1.97 |
-9.72 |
-0.77 |
0 |
|
|
212251 |
81059935 |
1 |
ON2C14H20 |
AB2C14D20 |
-24.2 |
5.29 |
-9.83 |
-0.58 |
0 |
|
|
212252 |
81059936 |
1 |
S2N4C15H20 |
A2B4C15D20 |
28.44 |
3.36 |
-8.57 |
-0.42 |
0 |
|
|
212253 |
81059940 |
1 |
OSN2H12C13 |
ABC2D12E13 |
34.72 |
4.62 |
-9.36 |
-0.7 |
0 |
|
|
212254 |
81059942 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-50.9 |
4.21 |
-9.88 |
-0.61 |
0 |
|
|
212255 |
81059943 |
1 |
ON2C14H18 |
AB2C14D18 |
-15.48 |
2.83 |
-9.88 |
-0.62 |
0 |
|
|
212256 |
81059944 |
1 |
ON2C13H16 |
AB2C13D16 |
7.81 |
2.73 |
-9.92 |
-0.65 |
0 |
|
|
212257 |
81059945 |
1 |
OSN4C15H24 |
ABC4D15E24 |
-41.89 |
4.92 |
-8.71 |
-0.72 |
0 |
|
|
212258 |
81059946 |
1 |
SO2N3C15H23 |
AB2C3D15E23 |
-82.92 |
5.44 |
-8.53 |
-0.45 |
0 |
|
|
212259 |
81059947 |
1 |
SN4C16H26 |
AB4C16D26 |
1.11 |
4.73 |
-8.63 |
-0.44 |
0 |
|
|
212260 |
81059948 |
1 |
SN3C13H21 |
AB3C13D21 |
-5.57 |
4.0 |
-8.59 |
-0.35 |
0 |
|
|
212261 |
81059949 |
1 |
SN3C9H13 |
AB3C9D13 |
18.41 |
3.88 |
-8.62 |
-0.43 |
0 |
|
|
212262 |
81059951 |
1 |
OSN3C16H21 |
ABC3D16E21 |
-16.32 |
3.76 |
-8.54 |
-0.34 |
0 |
|
|
212263 |
81059954 |
1 |
SN3C17H27 |
AB3C17D27 |
-14.82 |
3.79 |
-8.58 |
-0.38 |
0 |
|
|
212264 |
81059955 |
1 |
OSN4C15H24 |
ABC4D15E24 |
-50.48 |
6.6 |
-8.65 |
-0.51 |
0 |
|
|
212265 |
81059956 |
1 |
SN3C17H25 |
AB3C17D25 |
1.63 |
6.32 |
-8.46 |
-0.27 |
0 |
|
|
212266 |
81059959 |
1 |
SN3C16H25 |
AB3C16D25 |
-1.14 |
6.24 |
-8.47 |
-0.43 |
0 |
|
|
212267 |
81059960 |
1 |
S2N3C14H17 |
A2B3C14D17 |
43.13 |
2.91 |
-8.68 |
-0.52 |
0 |
|
|
212268 |
81059961 |
1 |
SN3C16H19 |
AB3C16D19 |
28.44 |
3.6 |
-8.66 |
-0.46 |
0 |
|
|
212269 |
81059964 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-66.58 |
6.68 |
-9.57 |
-0.74 |
0 |
|
|
212270 |
81059965 |
3 |
NOC5H7 |
ABC5D7 |
-142.52 |
6.98 |
-9.33 |
-0.53 |
0 |
|
|
212271 |
81059966 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-79.61 |
6.17 |
-9.21 |
-0.38 |
0 |
|
|
212272 |
81059969 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-106.56 |
4.74 |
-9.13 |
-0.37 |
0 |
|
|
212273 |
81059970 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-64.94 |
1.48 |
-9.85 |
-0.84 |
0 |
|
|
212274 |
81059971 |
2 |
N2C6H9 |
A2B6C9 |
36.84 |
6.35 |
-8.9 |
-0.22 |
0 |
|
|
212275 |
81059974 |
1 |
Cl2N3H11C14 |
A2B3C11D14 |
51.02 |
2.25 |
-9.19 |
-1.04 |
0 |
|
|
212276 |
81059975 |
1 |
N3C16H23 |
A3B16C23 |
18.11 |
4.89 |
-8.84 |
-0.39 |
0 |
|
|
212277 |
81059976 |
1 |
N3C16H17 |
A3B16C17 |
44.5 |
5.03 |
-8.88 |
-0.55 |
0 |
|
|
212278 |
81059977 |
1 |
N3C17H17 |
A3B17C17 |
62.32 |
4.56 |
-8.67 |
-0.62 |
0 |
|
|
212279 |
81059982 |
1 |
N4H14C17 |
A4B14C17 |
120.42 |
5.56 |
-9.16 |
-1.2 |
0 |
|
|
212280 |
81059983 |
1 |
ON2C18H26 |
AB2C18D26 |
-39.09 |
5.8 |
-9.69 |
-0.52 |
0 |
|
|
212281 |
81060007 |
3 |
NC5H7 |
AB5C7 |
18.83 |
5.14 |
-8.78 |
-0.27 |
0 |
|
|
212282 |
81060008 |
1 |
N3C14H21 |
A3B14C21 |
7.2 |
5.27 |
-9.1 |
-0.34 |
0 |
|
|
212283 |
81060009 |
1 |
SCl3N3H12C14 |
AB3C3D12E14 |
24.99 |
4.26 |
-8.86 |
-1.05 |
0 |
|
|
212284 |
81060010 |
2 |
N2C7H10 |
A2B7C10 |
32.68 |
5.19 |
-8.93 |
-0.24 |
0 |
|
|
212285 |
81060011 |
1 |
N3C13H19 |
A3B13C19 |
15.93 |
5.2 |
-9.04 |
-0.32 |
0 |
|
|
212286 |
81060013 |
1 |
SN3C17H19 |
AB3C17D19 |
42.41 |
5.03 |
-8.56 |
-0.58 |
0 |
|
|
212287 |
81060017 |
1 |
ON4C13H16 |
AB4C13D16 |
-10.42 |
2.12 |
-9.44 |
-0.62 |
0 |
|
|
212288 |
81060019 |
1 |
ON3H15C16 |
AB3C15D16 |
32.55 |
3.61 |
-9.16 |
-0.59 |
0 |
|
|
212289 |
81060027 |
1 |
ON3C14H19 |
AB3C14D19 |
-4.79 |
3.9 |
-8.96 |
-0.39 |
0 |
|
|
212290 |
81060036 |
1 |
FSN3C16H18 |
ABC3D16E18 |
-11.17 |
4.95 |
-8.64 |
-0.49 |
0 |
|
|
212291 |
81060037 |
1 |
OSN3C16H19 |
ABC3D16E19 |
-0.96 |
4.58 |
-8.52 |
-0.44 |
0 |
|
|
212292 |
81060043 |
1 |
ON2C12H16 |
AB2C12D16 |
-19.14 |
5.6 |
-9.76 |
-0.52 |
0 |
|
|
212293 |
81060044 |
1 |
OSN5C14H19 |
ABC5D14E19 |
25.07 |
1.32 |
-8.66 |
-0.53 |
0 |
|
|
212294 |
81060051 |
1 |
SN3C17H21 |
AB3C17D21 |
38.27 |
5.51 |
-8.34 |
-0.19 |
0 |
|
|
212295 |
81060052 |
1 |
FSN3C16H18 |
ABC3D16E18 |
-0.24 |
5.9 |
-8.54 |
-0.56 |
0 |
|
|
212296 |
81060060 |
1 |
FSN3C15H16 |
ABC3D15E16 |
3.22 |
2.91 |
-8.63 |
-0.54 |
0 |
|
|
212297 |
81060062 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-60.11 |
7.74 |
-9.16 |
-0.4 |
0 |
|
|
212298 |
81060064 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-73.26 |
6.41 |
-9.54 |
-1.01 |
0 |
|
|
212299 |
81060065 |
1 |
O2F3N3C12H12 |
A2B3C3D12E12 |
-199.16 |
5.31 |
-10.44 |
-1.31 |
0 |
|
|
212300 |
81060072 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-57.77 |
5.35 |
-9.18 |
-0.62 |
0 |
|
|
212301 |
81060074 |
1 |
ClN3H14C15 |
AB3C14D15 |
48.6 |
3.6 |
-9.27 |
-0.69 |
0 |
|
|
212302 |
81060077 |
1 |
ClN3H12C14 |
AB3C12D14 |
56.3 |
3.19 |
-9.19 |
-0.83 |
0 |
|
|
212303 |
81060080 |
1 |
FN3C16H16 |
AB3C16D16 |
18.68 |
5.35 |
-9.02 |
-0.49 |
0 |
|
|
212304 |
81060083 |
3 |
NC5H7 |
AB5C7 |
9.3 |
5.41 |
-9.06 |
-0.34 |
0 |
|
|
212305 |
81060085 |
1 |
N2O2C17H18 |
A2B2C17D18 |
-14.06 |
4.24 |
-9.14 |
-0.77 |
0 |
|
|
212306 |
81060087 |
1 |
SO2N3C12H15 |
AB2C3D12E15 |
-40.18 |
5.79 |
-9.55 |
-0.8 |
0 |
|
|
212307 |
81060088 |
1 |
F3N3C11H12 |
A3B3C11D12 |
-118.07 |
2.95 |
-9.42 |
-0.67 |
0 |
|
|
212308 |
81060089 |
1 |
ON3C14H19 |
AB3C14D19 |
-12.44 |
3.79 |
-8.94 |
-0.44 |
0 |
|
|
212309 |
81060090 |
1 |
ON3C13H17 |
AB3C13D17 |
-11.55 |
4.49 |
-9.05 |
-0.47 |
0 |
|
|
212310 |
81060091 |
1 |
ON3C14H15 |
AB3C14D15 |
34.75 |
4.64 |
-9.0 |
-0.4 |
0 |
|
|
212311 |
81060092 |
1 |
N3C16H23 |
A3B16C23 |
21.25 |
5.37 |
-8.72 |
-0.27 |
0 |
|
|
212312 |
81060093 |
1 |
N3C15H23 |
A3B15C23 |
2.22 |
5.24 |
-9.09 |
-0.34 |
0 |
|
|
212313 |
81060094 |
1 |
ON4C13H18 |
AB4C13D18 |
-8.81 |
5.34 |
-9.46 |
-0.62 |
0 |
|
|
212314 |
81060097 |
1 |
SN3C16H19 |
AB3C16D19 |
51.03 |
5.42 |
-9.09 |
-0.45 |
0 |
|
|
212315 |
81060098 |
1 |
SN3C15H17 |
AB3C15D17 |
66.02 |
5.0 |
-8.89 |
-0.55 |
0 |
|
|
212316 |
81060100 |
1 |
N3C15H23 |
A3B15C23 |
10.99 |
5.31 |
-8.7 |
-0.2 |
0 |
|
|
212317 |
81060125 |
1 |
SN3C13H17 |
AB3C13D17 |
26.99 |
5.28 |
-8.96 |
-0.32 |
0 |
|
|
212318 |
81060126 |
1 |
SN3C14H19 |
AB3C14D19 |
22.47 |
5.17 |
-8.94 |
-0.29 |
0 |
|
|
212319 |
81060130 |
1 |
ON2C16H16 |
AB2C16D16 |
14.27 |
5.81 |
-9.44 |
-0.7 |
0 |