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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
33337 |
7886004 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-69.94 |
3.73 |
-8.84 |
-1.23 |
0 |
|
|
33338 |
7886006 |
1 |
ClSO2N4H13C16 |
ABC2D4E13F16 |
-12.32 |
2.65 |
-8.98 |
-1.41 |
0 |
|
|
33339 |
7886010 |
1 |
SO2N3H21C24 |
AB2C3D21E24 |
1.76 |
3.84 |
-8.85 |
-1.38 |
0 |
|
|
33340 |
7886015 |
1 |
SN2O4H18C19 |
AB2C4D18E19 |
-81.16 |
6.4 |
-8.53 |
-0.88 |
0 |
|
|
33341 |
7886016 |
1 |
SN2O2H16C17 |
AB2C2D16E17 |
-15.96 |
1.35 |
-8.63 |
-0.97 |
0 |
|
|
33342 |
7886019 |
1 |
S2O3N4C17H18 |
A2B3C4D17E18 |
-66.54 |
5.25 |
-8.42 |
-0.96 |
0 |
|
|
33343 |
7886020 |
1 |
SO3N4C15H16 |
AB3C4D15E16 |
-69.82 |
4.61 |
-8.59 |
-0.96 |
0 |
|
|
33344 |
7886021 |
1 |
OS2N3H17C20 |
AB2C3D17E20 |
67.41 |
3.71 |
-8.59 |
-1.1 |
0 |
|
|
33345 |
7886022 |
1 |
SO3N4C14H16 |
AB3C4D14E16 |
-97.45 |
1.63 |
-8.93 |
-1.35 |
0 |
|
|
33346 |
7886025 |
2 |
OSN2C9H10 |
ABC2D9E10 |
-2.15 |
6.04 |
-8.6 |
-1.13 |
0 |
|
|
33347 |
7886029 |
1 |
SN3O4C18H21 |
AB3C4D18E21 |
-140.39 |
4.45 |
-8.7 |
-1.06 |
0 |
|
|
33348 |
7886030 |
1 |
N2S2O3C18H22 |
A2B2C3D18E22 |
-98.17 |
3.14 |
-8.44 |
-0.97 |
0 |
|
|
33349 |
7886032 |
1 |
SN3O4H19C20 |
AB3C4D19E20 |
-109.51 |
5.7 |
-8.97 |
-1.38 |
0 |
|
|
33350 |
7886033 |
1 |
OSN2C20H22 |
ABC2D20E22 |
-0.87 |
1.71 |
-8.58 |
-0.94 |
0 |
|
|
33351 |
7886036 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-73.6 |
3.51 |
-8.82 |
-1.21 |
0 |
|
|
33352 |
7886040 |
2 |
NSO2H9C10 |
ABC2D9E10 |
-80.96 |
1.66 |
-8.58 |
-1.08 |
0 |
|
|
33353 |
7886042 |
1 |
SO2N3H17C20 |
AB2C3D17E20 |
-5.55 |
5.64 |
-8.42 |
-0.74 |
0 |
|
|
33354 |
7886051 |
1 |
SN2O3H16C18 |
AB2C3D16E18 |
-50.02 |
3.62 |
-8.67 |
-1.04 |
0 |
|
|
33355 |
7886061 |
1 |
SN3O4C14H15 |
AB3C4D14E15 |
-136.54 |
3.23 |
-8.68 |
-1.07 |
0 |
|
|
33356 |
7886062 |
1 |
ClSN2O2H15C17 |
ABC2D2E15F17 |
-24.22 |
2.74 |
-8.62 |
-0.95 |
0 |
|
|
33357 |
7886067 |
1 |
S2O3N4C18H22 |
A2B3C4D18E22 |
-91.08 |
2.37 |
-8.61 |
-1.09 |
0 |
|
|
33358 |
7886072 |
1 |
SN2O3C18H18 |
AB2C3D18E18 |
-54.5 |
1.62 |
-8.53 |
-0.94 |
0 |
|
|
33359 |
7886073 |
1 |
SO3N4H18C19 |
AB3C4D18E19 |
-60.07 |
5.27 |
-8.58 |
-0.96 |
0 |
|
|
33360 |
7886081 |
1 |
SO2N3H19C20 |
AB2C3D19E20 |
-29.73 |
2.64 |
-8.58 |
-1.28 |
0 |
|
|
33361 |
7886087 |
1 |
SN2O3H14C17 |
AB2C3D14E17 |
-40.79 |
0.82 |
-8.66 |
-1.04 |
0 |
|
|
33362 |
7886090 |
1 |
O2S2N3C21H27 |
A2B2C3D21E27 |
-49.59 |
3.75 |
-8.54 |
-1.05 |
0 |
|
|
33363 |
7886091 |
1 |
SN2O2H18C19 |
AB2C2D18E19 |
-26.82 |
3.88 |
-8.56 |
-0.91 |
0 |
|
|
33364 |
7886092 |
1 |
O2S2N3C21H27 |
A2B2C3D21E27 |
-51.14 |
6.14 |
-8.37 |
-0.91 |
0 |
|
|
33365 |
7886093 |
1 |
SO2N4C17H18 |
AB2C4D17E18 |
-24.8 |
4.85 |
-8.89 |
-1.3 |
0 |
|
|
33366 |
7886094 |
1 |
S2N3O3C20H21 |
A2B3C3D20E21 |
-36.8 |
5.22 |
-8.37 |
-0.84 |
0 |
|
|
33367 |
7886095 |
1 |
SN2O3H18C21 |
AB2C3D18E21 |
-56.76 |
6.05 |
-8.78 |
-1.24 |
0 |
|
|
33368 |
7886097 |
2 |
OSN2C10H11 |
ABC2D10E11 |
-13.1 |
4.48 |
-8.74 |
-1.24 |
0 |
|
|
33369 |
7886099 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-26.65 |
4.32 |
-8.71 |
-1.08 |
0 |
|
|
33370 |
7886101 |
1 |
OSN2F3H13C17 |
ABC2D3E13F17 |
-136.96 |
3.14 |
-8.76 |
-1.13 |
0 |
|
|
33371 |
7886104 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-25.61 |
5.06 |
-8.52 |
-0.87 |
0 |
|
|
33372 |
7886117 |
1 |
O2S2N3C20H21 |
A2B2C3D20E21 |
-18.11 |
3.4 |
-8.74 |
-1.36 |
0 |
|
|
33373 |
7886122 |
1 |
O2S2N3C21H21 |
A2B2C3D21E21 |
-24.32 |
5.21 |
-8.49 |
-0.81 |
0 |
|
|
33374 |
7886127 |
1 |
OSN2C18H18 |
ABC2D18E18 |
12.73 |
0.91 |
-8.63 |
-1.0 |
0 |
|
|
33375 |
7886139 |
1 |
SO2N3C23H25 |
AB2C3D23E25 |
-32.38 |
4.65 |
-8.51 |
-0.84 |
0 |
|
|
33376 |
7886141 |
1 |
N2S2O3H16C18 |
A2B2C3D16E18 |
-44.55 |
3.35 |
-8.84 |
-1.16 |
0 |
|
|
33377 |
7886143 |
1 |
SO3N4C20H20 |
AB3C4D20E20 |
-74.79 |
4.86 |
-8.61 |
-0.98 |
0 |
|
|
33378 |
7886144 |
1 |
N2O2S2C21H22 |
A2B2C2D21E22 |
-16.8 |
5.18 |
-8.63 |
-1.07 |
0 |
|
|
33379 |
7886146 |
1 |
SF2O2N3H17C19 |
AB2C2D3E17F19 |
-121.68 |
1.97 |
-8.82 |
-1.22 |
0 |
|
|
33380 |
7886150 |
1 |
ON2S3C18H18 |
AB2C3D18E18 |
38.33 |
2.2 |
-8.72 |
-1.11 |
0 |
|
|
33381 |
7886181 |
1 |
SO2N3C22H25 |
AB2C3D22E25 |
-49.02 |
3.14 |
-9.09 |
-1.37 |
0 |
|
|
33382 |
7886189 |
1 |
SO2N3H23C24 |
AB2C3D23E24 |
-11.5 |
2.76 |
-9.13 |
-1.4 |
0 |
|
|
33383 |
7886194 |
1 |
S2O3N4H18C19 |
A2B3C4D18E19 |
12.55 |
12.21 |
-9.37 |
-1.7 |
0 |
|
|
33384 |
7886197 |
1 |
SO2N3H19C23 |
AB2C3D19E23 |
6.11 |
2.94 |
-9.05 |
-1.28 |
0 |
|
|
33385 |
7886201 |
1 |
SN3O3H17C22 |
AB3C3D17E22 |
-32.48 |
4.49 |
-9.29 |
-1.57 |
0 |
|
|
33386 |
7886209 |
1 |
O2S2N4C17H22 |
A2B2C4D17E22 |
-73.26 |
2.43 |
-8.94 |
-1.15 |
0 |
|
|
33387 |
7886213 |
2 |
OSN2H9C10 |
ABC2D9E10 |
-9.96 |
4.14 |
-8.81 |
-1.21 |
0 |
|
|
33388 |
7886216 |
1 |
FSO2N3H16C21 |
ABC2D3E16F21 |
-39.71 |
2.52 |
-9.16 |
-1.44 |
0 |
|
|
33389 |
7886221 |
1 |
FOS2N3H18C19 |
ABC2D3E18F19 |
-28.15 |
4.82 |
-8.91 |
-1.15 |
0 |
|
|
33390 |
7886227 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-40.39 |
3.02 |
-9.12 |
-1.4 |
0 |
|
|
33391 |
7886228 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-41.51 |
2.88 |
-9.18 |
-1.34 |
0 |
|
|
33392 |
7886231 |
1 |
OS3N4H14C17 |
AB3C4D14E17 |
50.96 |
5.22 |
-8.66 |
-1.33 |
0 |
|
|
33393 |
7886233 |
1 |
OS2N4H18C20 |
AB2C4D18E20 |
42.56 |
4.67 |
-8.71 |
-1.12 |
0 |
|
|
33394 |
7886238 |
1 |
SN2O4H18C22 |
AB2C4D18E22 |
-54.27 |
6.01 |
-8.76 |
-1.05 |
0 |
|
|
33395 |
7886240 |
1 |
OS2N3C21H23 |
AB2C3D21E23 |
11.54 |
4.68 |
-8.85 |
-1.09 |
0 |
|
|
33396 |
7886241 |
1 |
SO3N4H14C18 |
AB3C4D14E18 |
4.26 |
5.37 |
-8.87 |
-1.1 |
0 |
|
|
33397 |
7886251 |
1 |
SN3O3C23H23 |
AB3C3D23E23 |
-45.45 |
6.44 |
-8.69 |
-0.88 |
0 |
|
|
33398 |
7886255 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-34.34 |
3.43 |
-9.05 |
-1.14 |
0 |
|
|
33399 |
7886256 |
1 |
OF2N2S2H14C18 |
AB2C2D2E14F18 |
-56.32 |
2.24 |
-8.9 |
-1.14 |
0 |
|
|
33400 |
7886258 |
2 |
NOSC10H10 |
ABCD10E10 |
-19.29 |
8.46 |
-8.56 |
-0.8 |
0 |
|
|
33401 |
7886272 |
1 |
OS2N4C18H22 |
AB2C4D18E22 |
9.35 |
7.94 |
-9.04 |
-1.26 |
0 |
|
|
33402 |
7886279 |
1 |
SO2N4H18C20 |
AB2C4D18E20 |
3.38 |
5.74 |
-9.26 |
-1.53 |
0 |
|
|
33403 |
7886282 |
1 |
S2O3N4C19H24 |
A2B3C4D19E24 |
-96.59 |
2.46 |
-8.85 |
-1.1 |
0 |
|
|
33404 |
7886288 |
1 |
OS2N3C17H23 |
AB2C3D17E23 |
-25.51 |
5.03 |
-8.97 |
-1.22 |
0 |
|
|
33405 |
7886289 |
1 |
SN2O3H18C22 |
AB2C3D18E22 |
-27.97 |
5.47 |
-8.8 |
-1.03 |
0 |
|
|
33406 |
7886300 |
1 |
FO2S2N4H17C19 |
AB2C2D4E17F19 |
-36.72 |
2.16 |
-8.95 |
-1.17 |
0 |
|
|
33407 |
7886302 |
1 |
O2S2N3H19C20 |
A2B2C3D19E20 |
-20.32 |
6.68 |
-8.55 |
-0.84 |
0 |
|
|
33408 |
7886303 |
1 |
NO6C19H21 |
AB6C19D21 |
-209.09 |
7.64 |
-8.72 |
-0.65 |
0 |
|
|
33409 |
7886316 |
1 |
FSO2N3H18C19 |
ABC2D3E18F19 |
-69.68 |
5.46 |
-8.94 |
-0.72 |
0 |
|
|
33410 |
7886329 |
1 |
FOSN5C19H20 |
ABCD5E19F20 |
19.34 |
5.86 |
-9.22 |
-0.7 |
0 |
|
|
33411 |
7886330 |
1 |
FOS2N3H18C19 |
ABC2D3E18F19 |
-24.72 |
1.87 |
-8.97 |
-1.3 |
0 |
|
|
33412 |
7886334 |
1 |
O6C19H20 |
A6B19C20 |
-185.77 |
2.83 |
-8.68 |
-0.74 |
0 |
|
|
33413 |
7886338 |
1 |
S2N3O3H19C20 |
A2B3C3D19E20 |
-48.19 |
2.94 |
-8.41 |
-1.18 |
0 |
|
|
33414 |
7886339 |
1 |
FOS2N4C20H21 |
ABC2D4E20F21 |
5.01 |
4.45 |
-8.79 |
-0.74 |
0 |
|
|
33415 |
7886341 |
2 |
O3C10H11 |
A3B10C11 |
-201.19 |
1.61 |
-8.61 |
-0.59 |
0 |
|
|
33416 |
7886348 |
1 |
OS2N3C22H23 |
AB2C3D22E23 |
12.38 |
1.04 |
-8.68 |
-0.91 |
0 |
|
|
33417 |
7886364 |
1 |
O2S2N3C18H19 |
A2B2C3D18E19 |
-17.86 |
2.39 |
-8.82 |
-1.06 |
0 |
|
|
33418 |
7886365 |
1 |
N2O5C21H22 |
A2B5C21D22 |
-154.26 |
2.36 |
-8.69 |
-0.76 |
0 |
|
|
33419 |
7886368 |
1 |
OS2N3C18H23 |
AB2C3D18E23 |
-27.33 |
2.15 |
-8.83 |
-1.09 |
0 |
|
|
33420 |
7886370 |
1 |
OS2N3C18H23 |
AB2C3D18E23 |
-27.26 |
2.1 |
-8.84 |
-1.1 |
0 |
|
|
33421 |
7886371 |
1 |
SN3O3C22H25 |
AB3C3D22E25 |
-91.27 |
3.08 |
-9.04 |
-0.2 |
0 |
|
|
33422 |
7886373 |
1 |
FN3O3C21H22 |
AB3C3D21E22 |
-133.03 |
4.01 |
-8.89 |
-0.2 |
0 |
|
|
33423 |
7886375 |
1 |
FN3O3C21H22 |
AB3C3D21E22 |
-134.96 |
2.27 |
-9.25 |
-0.21 |
0 |
|
|
33424 |
7886378 |
1 |
O2S2N4C15H18 |
A2B2C4D15E18 |
-56.12 |
3.88 |
-8.94 |
-1.13 |
0 |
|
|
33425 |
7886387 |
1 |
ClFN3O3H19C20 |
ABC3D3E19F20 |
-134.72 |
2.01 |
-9.85 |
-0.57 |
0 |
|
|
33426 |
7886398 |
1 |
N2S2O3C20H20 |
A2B2C3D20E20 |
-54.08 |
5.57 |
-8.44 |
-0.71 |
0 |
|
|
33427 |
7886399 |
3 |
NO2H5C6 |
AB2C5D6 |
-85.75 |
8.67 |
-8.91 |
-1.68 |
0 |
|
|
33428 |
7886400 |
1 |
OS2N3C13H15 |
AB2C3D13E15 |
-9.81 |
6.3 |
-8.92 |
-1.12 |
0 |
|
|
33429 |
7886418 |
1 |
O2S2N3C20H21 |
A2B2C3D20E21 |
-26.85 |
2.28 |
-8.69 |
-1.14 |
0 |
|
|
33430 |
7886420 |
1 |
Cl2O3N5C13H13 |
A2B3C5D13E13 |
-13.35 |
4.66 |
-9.65 |
-1.3 |
0 |
|
|
33431 |
7886421 |
1 |
OS2N3C21H21 |
AB2C3D21E21 |
19.22 |
0.79 |
-8.63 |
-1.01 |
0 |
|
|
33432 |
7886425 |
1 |
OS2N3C23H27 |
AB2C3D23E27 |
-6.24 |
6.24 |
-8.88 |
-1.09 |
0 |
|
|
33433 |
7886442 |
1 |
OS2N4C19H24 |
AB2C4D19E24 |
1.25 |
5.3 |
-8.67 |
-0.91 |
0 |
|
|
33434 |
7886459 |
1 |
FOS2N3C21H22 |
ABC2D3E21F22 |
-40.68 |
2.76 |
-8.66 |
-0.9 |
0 |
|
|
33435 |
7886462 |
1 |
OS3N4C17H18 |
AB3C4D17E18 |
59.42 |
5.18 |
-8.64 |
-1.27 |
0 |
|
|
33436 |
7886464 |
1 |
FOS2N4H15C16 |
ABC2D4E15F16 |
14.58 |
5.15 |
-8.78 |
-1.2 |
0 |