List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
338267 |
127258959 |
1 |
NSO8H14C19 |
ABC8D14E19 |
-169.55 |
2.88 |
0.0 |
0.0 |
0 |
|
|
338271 |
127258963 |
1 |
BrNO3C8H8 |
ABC3D8E8 |
-87.06 |
2.47 |
-9.94 |
-0.98 |
0 |
|
|
338272 |
127258964 |
2 |
NSO3C4H10 |
ABC3D4E10 |
-279.57 |
7.87 |
-9.44 |
-0.07 |
0 |
|
|
338273 |
127258965 |
1 |
BFO4H12C14 |
ABC4D12E14 |
-234.17 |
1.56 |
-9.66 |
-0.97 |
0 |
|
|
338274 |
127258966 |
1 |
NBr3H4C6 |
AB3C4D6 |
27.15 |
2.5 |
-9.91 |
-1.02 |
0 |
|
|
338275 |
127258967 |
1 |
NCl2O3C7H15 |
AB2C3D7E15 |
-209.15 |
2.47 |
-9.34 |
0.24 |
0 |
|
|
338276 |
127258968 |
1 |
OCl3N3C20H28 |
AB3C3D20E28 |
-95.01 |
8.42 |
-9.22 |
-1.14 |
0 |
|
|
338277 |
127258969 |
1 |
OCl3N3C20H28 |
AB3C3D20E28 |
-84.4 |
2.73 |
-8.88 |
-0.78 |
0 |
|
|
338278 |
127258970 |
1 |
ClN3H4C6 |
AB3C4D6 |
71.82 |
4.47 |
-10.73 |
-1.76 |
0 |
|
|
338279 |
127258971 |
1 |
ClSN2C3O3H7 |
ABC2D3E3F7 |
-158.55 |
2.97 |
-10.48 |
-0.77 |
0 |
|
|
338280 |
127258972 |
1 |
ClN2C9H13 |
AB2C9D13 |
7.68 |
7.77 |
-9.9 |
-0.48 |
0 |
|
|
338281 |
127258973 |
1 |
Cl2N2C9H14 |
A2B2C9D14 |
-22.64 |
4.08 |
-9.7 |
-0.23 |
0 |
|
|
338282 |
127258974 |
1 |
ClOSC5N6H11 |
ABCD5E6F11 |
14.38 |
2.0 |
-9.41 |
-1.1 |
0 |
|
|
338283 |
127258975 |
1 |
OSC5N6H10 |
ABC5D6E10 |
46.8 |
2.43 |
-9.08 |
-0.65 |
0 |
|
|
338284 |
127258976 |
1 |
BrClNOC8H11 |
ABCDE8F11 |
-57.23 |
1.87 |
-8.86 |
-0.36 |
0 |
|
|
338285 |
127258977 |
1 |
NCl2O4C20H21 |
AB2C4D20E21 |
-149.89 |
3.08 |
-9.02 |
-0.25 |
0 |
|
|
338286 |
127258978 |
1 |
Cl3O3C16H21 |
A3B3C16D21 |
-166.07 |
2.58 |
-9.04 |
-0.71 |
0 |
|
|
338287 |
127258979 |
1 |
Cl2O3C16H22 |
A2B3C16D22 |
-160.41 |
4.61 |
-8.97 |
-0.45 |
0 |
|
|
338288 |
127258980 |
1 |
NCl3O4C13H16 |
AB3C4D13E16 |
-180.36 |
2.72 |
-9.23 |
-0.96 |
0 |
|
|
338289 |
127258981 |
2 |
NOC2H5 |
ABC2D5 |
-79.06 |
3.26 |
-9.38 |
0.56 |
0 |
|
|
338290 |
127258982 |
1 |
O3C12H16 |
A3B12C16 |
-125.02 |
0.58 |
-8.79 |
0.34 |
0 |
|
|
338291 |
127258983 |
1 |
N4O6C19H28 |
A4B6C19D28 |
-243.14 |
3.17 |
-9.44 |
-0.08 |
0 |
|
|
338292 |
127258984 |
1 |
BrN2H11C13 |
AB2C11D13 |
65.32 |
2.46 |
-9.07 |
-1.66 |
0 |
|
|
338293 |
127258985 |
1 |
NO2C12H13 |
AB2C12D13 |
-46.11 |
3.88 |
-9.79 |
-0.12 |
0 |
|
|
338294 |
127258986 |
1 |
NO3C16H21 |
AB3C16D21 |
-125.87 |
2.86 |
-9.12 |
0.12 |
0 |
|
|
338295 |
127258987 |
1 |
ClNO3C23H30 |
ABC3D23E30 |
-140.24 |
3.15 |
-8.99 |
0.22 |
0 |
|
|
338296 |
127258988 |
1 |
NO3C23H29 |
AB3C23D29 |
-106.38 |
2.74 |
-9.03 |
0.21 |
0 |
|
|
338297 |
127258989 |
1 |
NO4C26H37 |
AB4C26D37 |
-170.13 |
4.28 |
-8.68 |
0.18 |
0 |
|
|
338298 |
127258990 |
2 |
NO3C10H14 |
AB3C10D14 |
-237.92 |
4.04 |
-9.38 |
0.03 |
0 |
|
|
338299 |
127258991 |
1 |
ClSO3C24H41 |
ABC3D24E41 |
-198.47 |
6.33 |
-10.34 |
-0.91 |
0 |
|
|
338300 |
127258992 |
1 |
SO3C14H14 |
AB3C14D14 |
-80.54 |
4.92 |
-9.12 |
-0.79 |
0 |
|
|
338301 |
127258993 |
1 |
NO2C12H17 |
AB2C12D17 |
-78.62 |
3.66 |
-9.36 |
-0.76 |
0 |
|
|
338302 |
127258994 |
1 |
Na2P2N5C10O10H11 |
A2B2C5D10E10F11 |
-624.16 |
7.48 |
-9.3 |
-0.96 |
0 |
|
|
338303 |
127258995 |
1 |
NaP3N5C10O12H15 |
AB3C5D10E12F15 |
-721.75 |
3.99 |
-8.56 |
-0.69 |
0 |
|
|
338304 |
127258996 |
1 |
PNa4N5O11C14H14 |
AB4C5D11E14F14 |
-623.9 |
12.97 |
-7.76 |
-1.16 |
0 |
|
|
338305 |
127258997 |
1 |
NO2C18H27 |
AB2C18D27 |
-92.88 |
2.32 |
-8.73 |
0.43 |
0 |
|
|
338306 |
127258998 |
1 |
ClNO2C18H28 |
ABC2D18E28 |
-125.58 |
3.17 |
-8.63 |
0.41 |
0 |
|
|
338307 |
127258999 |
1 |
NO3C18H27 |
AB3C18D27 |
-121.26 |
1.67 |
-8.89 |
0.34 |
0 |
|
|
338308 |
127259000 |
1 |
NO4C17H23 |
AB4C17D23 |
-120.95 |
5.81 |
-9.81 |
-0.71 |
0 |
|
|
338309 |
127259001 |
2 |
ClNSC4H9 |
ABCD4E9 |
-57.08 |
3.45 |
-8.88 |
-0.11 |
0 |
|
|
338310 |
127259002 |
2 |
NSC4H8 |
ABC4D8 |
13.85 |
2.63 |
-8.83 |
0.14 |
0 |
|
|
338311 |
127259003 |
1 |
SO5C16H18 |
AB5C16D18 |
-164.31 |
5.87 |
-9.03 |
-0.62 |
0 |
|
|
338312 |
127259004 |
1 |
NPNa2O9C30H42 |
ABC2D9E30F42 |
-583.31 |
22.54 |
-7.96 |
-0.56 |
0 |
|
|
338313 |
127259005 |
2 |
N2O3C10H11 |
A2B3C10D11 |
-140.92 |
5.96 |
-9.78 |
-1.68 |
0 |
|
|
338314 |
127259006 |
1 |
N5O6C17H23 |
A5B6C17D23 |
-180.18 |
11.55 |
-9.97 |
-1.4 |
0 |
|
|
338315 |
127259007 |
1 |
SN2O4C20H20 |
AB2C4D20E20 |
-90.58 |
6.65 |
-8.66 |
-0.69 |
0 |
|
|
338316 |
127259008 |
1 |
N4O4C17H18 |
A4B4C17D18 |
-44.84 |
6.98 |
-9.9 |
-1.63 |
0 |
|
|
338317 |
127259009 |
1 |
N5O7C26H33 |
A5B7C26D33 |
-297.91 |
2.82 |
-9.18 |
-1.0 |
0 |
|
|
338318 |
127259010 |
1 |
BrN2O4C14H19 |
AB2C4D14E19 |
-146.12 |
0.48 |
-9.68 |
-0.4 |
0 |
|
|
338319 |
127259011 |
1 |
SN3C10H11 |
AB3C10D11 |
75.01 |
4.31 |
-9.31 |
-0.37 |
0 |
|
|
338320 |
127259012 |
1 |
OSN3C10H11 |
ABC3D10E11 |
45.31 |
5.4 |
-9.17 |
-0.43 |
0 |
|
|
338321 |
127259013 |
1 |
SN3C9H9 |
AB3C9D9 |
90.52 |
3.42 |
-9.3 |
-0.54 |
0 |
|
|
338322 |
127259014 |
1 |
ClON2C12H19 |
ABC2D12E19 |
-43.95 |
3.07 |
-9.62 |
-0.12 |
0 |
|
|
338323 |
127259015 |
1 |
NSO2C4H7 |
ABC2D4E7 |
-77.48 |
6.62 |
-8.5 |
-0.13 |
0 |
|
|
338324 |
127259016 |
2 |
SO2C8H10 |
AB2C8D10 |
-116.99 |
5.16 |
-8.94 |
-0.93 |
0 |
|
|
338325 |
127259017 |
1 |
SO3C11H14 |
AB3C11D14 |
-109.79 |
1.93 |
-8.97 |
0.03 |
0 |
|
|
338326 |
127259018 |
1 |
SO3C16H22 |
AB3C16D22 |
-111.3 |
1.58 |
-8.7 |
0.12 |
0 |
|
|
338327 |
127259019 |
1 |
SO3C17H22 |
AB3C17D22 |
-113.89 |
2.02 |
-8.96 |
0.14 |
0 |
|
|
338328 |
127259020 |
1 |
N2O3C11H16 |
A2B3C11D16 |
-125.15 |
3.54 |
-9.09 |
-0.2 |
0 |
|
|
338329 |
127259021 |
1 |
O3C19H22 |
A3B19C22 |
-103.42 |
2.29 |
-8.53 |
-0.21 |
0 |
|
|
338330 |
127259022 |
1 |
N2O2C9H10 |
A2B2C9D10 |
-24.03 |
1.19 |
-8.54 |
-0.15 |
0 |
|
|
338331 |
127259023 |
1 |
NO2C10H11 |
AB2C10D11 |
-46.94 |
2.31 |
-9.1 |
-0.01 |
0 |
|
|
338332 |
127259024 |
1 |
O4C17H18 |
A4B17C18 |
-130.37 |
3.29 |
-9.44 |
-0.04 |
0 |
|
|
338333 |
127259025 |
1 |
ClNO3C16H24 |
ABC3D16E24 |
-161.96 |
2.78 |
-8.72 |
0.27 |
0 |
|
|
338334 |
127259026 |
1 |
NO3C16H23 |
AB3C16D23 |
-122.54 |
1.85 |
-8.54 |
0.07 |
0 |
|
|
338335 |
127259027 |
1 |
NO7C17H25 |
AB7C17D25 |
-305.14 |
8.33 |
-9.56 |
-0.13 |
0 |
|
|
338336 |
127259028 |
1 |
NO3C15H23 |
AB3C15D23 |
-127.38 |
2.22 |
-8.89 |
0.36 |
0 |
|
|
338337 |
127259029 |
1 |
O4C17H18 |
A4B17C18 |
-129.02 |
2.4 |
-9.05 |
0.17 |
0 |
|
|
338338 |
127259030 |
1 |
SO4C20H32 |
AB4C20D32 |
-201.25 |
4.49 |
-10.19 |
-0.54 |
0 |
|
|
338339 |
127259031 |
1 |
SO4H12C14 |
AB4C12D14 |
-115.82 |
5.46 |
-9.88 |
-0.67 |
0 |
|
|
338340 |
127259032 |
1 |
PSO2H23C27 |
ABC2D23E27 |
15.37 |
7.24 |
-7.47 |
-0.4 |
0 |
|
|
338341 |
127259033 |
1 |
SO2H16C20 |
AB2C16D20 |
-12.77 |
3.08 |
-8.43 |
-0.31 |
0 |
|
|
338342 |
127259034 |
1 |
SO3C11H14 |
AB3C11D14 |
-109.9 |
1.68 |
-8.67 |
-0.21 |
0 |
|
|
338343 |
127259035 |
1 |
NSO4H11C14 |
ABC4D11E14 |
-41.72 |
6.51 |
-8.96 |
-1.43 |
0 |
|
|
338344 |
127259036 |
1 |
SO2H12C14 |
AB2C12D14 |
-36.63 |
1.75 |
-8.54 |
-0.41 |
0 |