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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
35350 |
7979735 |
1 |
ClN2O6C17H17 |
AB2C6D17E17 |
-149.17 |
2.99 |
-9.37 |
-1.5 |
0 |
|
|
35351 |
7979736 |
1 |
NO4C16H17 |
AB4C16D17 |
-121.19 |
6.05 |
-8.48 |
-0.59 |
0 |
|
|
35352 |
7979740 |
1 |
ClSN3O6C16H16 |
ABC3D6E16F16 |
-120.32 |
6.41 |
-9.43 |
-1.99 |
0 |
|
|
35353 |
7979744 |
1 |
ClNO5H14C16 |
ABC5D14E16 |
-81.92 |
4.91 |
-9.38 |
-1.48 |
0 |
|
|
35354 |
7979745 |
1 |
NO2C16H17 |
AB2C16D17 |
-63.56 |
3.87 |
-8.35 |
-0.12 |
0 |
|
|
35355 |
7979747 |
1 |
NO2C16H21 |
AB2C16D21 |
-85.42 |
5.11 |
-8.46 |
-0.01 |
0 |
|
|
35356 |
7979748 |
1 |
NO2C16H21 |
AB2C16D21 |
-84.81 |
3.36 |
-8.38 |
0.16 |
0 |
|
|
35357 |
7979749 |
1 |
ClFNO5H11C15 |
ABCD5E11F15 |
-117.7 |
1.64 |
-9.53 |
-1.6 |
0 |
|
|
35358 |
7979751 |
1 |
N2O3C18H18 |
A2B3C18D18 |
-93.93 |
6.43 |
-8.44 |
-0.62 |
0 |
|
|
35359 |
7979752 |
1 |
ClNO4H14C17 |
ABC4D14E17 |
-41.35 |
4.41 |
-9.39 |
-1.58 |
0 |
|
|
35360 |
7979753 |
1 |
SN2O6C18H20 |
AB2C6D18E20 |
-199.16 |
9.95 |
-8.54 |
-0.71 |
0 |
|
|
35361 |
7979754 |
1 |
ClN2O4C18H19 |
AB2C4D18E19 |
-66.35 |
2.59 |
-9.16 |
-1.76 |
0 |
|
|
35362 |
7979761 |
1 |
ClN2O6C17H17 |
AB2C6D17E17 |
-120.09 |
4.89 |
-8.57 |
-1.6 |
0 |
|
|
35363 |
7979765 |
1 |
ClFN2O4H12C15 |
ABC2D4E12F15 |
-96.2 |
3.09 |
-9.04 |
-1.7 |
0 |
|
|
35364 |
7979767 |
1 |
SN2O4C21H26 |
AB2C4D21E26 |
-127.9 |
3.7 |
-8.88 |
-0.55 |
0 |
|
|
35365 |
7979771 |
1 |
N2S2O3C19H24 |
A2B2C3D19E24 |
-86.79 |
6.23 |
-8.97 |
-0.6 |
0 |
|
|
35366 |
7979772 |
1 |
ClF2N2O5H11C15 |
AB2C2D5E11F15 |
-186.92 |
4.57 |
-9.22 |
-1.84 |
0 |
|
|
35367 |
7979773 |
1 |
N2S2O3C20H24 |
A2B2C3D20E24 |
-76.84 |
8.27 |
-8.86 |
-0.56 |
0 |
|
|
35368 |
7979774 |
1 |
NCl2O4H9C14 |
AB2C4D9E14 |
-38.79 |
3.72 |
-9.69 |
-1.54 |
0 |
|
|
35369 |
7979775 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-137.73 |
6.83 |
-8.49 |
-0.55 |
0 |
|
|
35370 |
7979776 |
1 |
ClN2O4H15C16 |
AB2C4D15E16 |
-56.01 |
2.65 |
-8.9 |
-1.59 |
0 |
|
|
35371 |
7979777 |
1 |
ClN2O4H15C16 |
AB2C4D15E16 |
-59.41 |
2.96 |
-8.69 |
-1.74 |
0 |
|
|
35372 |
7979778 |
1 |
SN2O5C20H24 |
AB2C5D20E24 |
-160.48 |
9.84 |
-8.88 |
-0.46 |
0 |
|
|
35373 |
7979779 |
1 |
ClN2O6H15C17 |
AB2C6D15E17 |
-134.67 |
6.7 |
-9.1 |
-1.97 |
0 |
|
|
35374 |
7979780 |
1 |
SN2O3C21H26 |
AB2C3D21E26 |
-90.01 |
6.29 |
-9.28 |
-0.6 |
0 |
|
|
35375 |
7979782 |
1 |
ClN2O6H17C18 |
AB2C6D17E18 |
-140.26 |
4.18 |
-9.42 |
-1.9 |
0 |
|
|
35376 |
7979783 |
1 |
SN2O3C20H24 |
AB2C3D20E24 |
-90.18 |
8.33 |
-9.15 |
-0.57 |
0 |
|
|
35377 |
7979784 |
1 |
ClN2O5H15C16 |
AB2C5D15E16 |
-86.08 |
3.04 |
-8.92 |
-1.77 |
0 |
|
|
35378 |
7979785 |
1 |
SN2O3C22H28 |
AB2C3D22E28 |
-98.34 |
5.72 |
-9.06 |
-0.56 |
0 |
|
|
35379 |
7979786 |
1 |
ClN2O6C15H17 |
AB2C6D15E17 |
-165.2 |
3.61 |
-9.65 |
-1.53 |
0 |
|
|
35380 |
7979787 |
1 |
SN2O3C22H28 |
AB2C3D22E28 |
-99.21 |
5.82 |
-9.09 |
-0.53 |
0 |
|
|
35381 |
7979788 |
1 |
ClN2O4C13H17 |
AB2C4D13E17 |
-95.35 |
2.9 |
-9.87 |
-1.75 |
0 |
|
|
35382 |
7979789 |
1 |
SN2O4C21H24 |
AB2C4D21E24 |
-118.17 |
8.62 |
-8.93 |
-0.86 |
0 |
|
|
35383 |
7979790 |
1 |
N2S2O3C20H24 |
A2B2C3D20E24 |
-80.02 |
5.92 |
-8.8 |
-0.6 |
0 |
|
|
35384 |
7979791 |
1 |
BrN2O2H13C19 |
AB2C2D13E19 |
24.01 |
3.74 |
-9.57 |
-1.58 |
0 |
|
|
35385 |
7979792 |
1 |
ClN2O4C13H17 |
AB2C4D13E17 |
-94.31 |
3.16 |
-9.75 |
-1.58 |
0 |
|
|
35386 |
7979793 |
1 |
N2O5C19H22 |
A2B5C19D22 |
-148.69 |
3.29 |
-8.86 |
-0.43 |
0 |
|
|
35387 |
7979794 |
1 |
ClN2F3O4H8C10 |
AB2C3D4E8F10 |
-230.54 |
5.33 |
-10.03 |
-1.89 |
0 |
|
|
35388 |
7979795 |
1 |
Cl2N3O4H9C15 |
A2B3C4D9E15 |
-18.92 |
8.07 |
-9.61 |
-2.07 |
0 |
|
|
35389 |
7979796 |
1 |
N3O4H11C13 |
A3B4C11D13 |
-65.42 |
3.17 |
-11.15 |
-1.69 |
0 |
|
|
35390 |
7979797 |
1 |
N3O4H11C13 |
A3B4C11D13 |
-67.03 |
4.47 |
-11.13 |
-1.53 |
0 |
|
|
35391 |
7979798 |
1 |
ClN3O5C19H22 |
AB3C5D19E22 |
-140.59 |
10.46 |
-9.46 |
-1.27 |
0 |
|
|
35392 |
7979799 |
1 |
ClN2O5C21H25 |
AB2C5D21E25 |
-166.16 |
3.24 |
-8.94 |
-0.57 |
0 |
|
|
35393 |
7979800 |
1 |
ClSN3O4H8C13 |
ABC3D4E8F13 |
-12.98 |
7.01 |
-9.29 |
-1.58 |
0 |
|
|
35394 |
7979801 |
1 |
N2O6C21H24 |
A2B6C21D24 |
-159.15 |
3.25 |
-8.43 |
-0.47 |
0 |
|
|
35395 |
7979802 |
1 |
ClN2O5C17H19 |
AB2C5D17E19 |
-94.92 |
7.58 |
-8.79 |
-1.22 |
0 |
|
|
35396 |
7979803 |
1 |
FSN2O4C18H19 |
ABC2D4E18F19 |
-146.64 |
1.77 |
-9.12 |
-0.66 |
0 |
|
|
35397 |
7979804 |
1 |
N2S2O4C19H20 |
A2B2C4D19E20 |
-88.0 |
1.71 |
-9.06 |
-0.74 |
0 |
|
|
35398 |
7979807 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-118.49 |
5.64 |
-9.61 |
-1.58 |
0 |
|
|
35399 |
7979808 |
1 |
N2O6H20C21 |
A2B6C20D21 |
-130.35 |
1.19 |
-9.11 |
-0.83 |
0 |
|
|
35400 |
7979809 |
1 |
ClN2O4H13C17 |
AB2C4D13E17 |
-27.3 |
1.64 |
-9.02 |
-1.54 |
0 |
|
|
35401 |
7979810 |
1 |
ClN2O4H13C17 |
AB2C4D13E17 |
-20.51 |
11.04 |
-9.28 |
-1.18 |
0 |
|
|
35402 |
7979811 |
1 |
N3O6C16H17 |
A3B6C16D17 |
-161.2 |
4.6 |
-9.18 |
-0.56 |
0 |
|
|
35403 |
7979812 |
1 |
ClFN3O5H11C15 |
ABC3D5E11F15 |
-125.42 |
10.95 |
-9.52 |
-1.33 |
0 |
|
|
35404 |
7979813 |
1 |
SN2O6C18H20 |
AB2C6D18E20 |
-177.47 |
5.74 |
-9.16 |
-0.67 |
0 |
|
|
35405 |
7979814 |
1 |
ClN2O4C17H17 |
AB2C4D17E17 |
-55.88 |
3.49 |
-9.38 |
-1.8 |
0 |
|
|
35406 |
7979816 |
1 |
ClSN2O4C19H21 |
ABC2D4E19F21 |
-113.56 |
4.51 |
-8.86 |
-0.46 |
0 |
|
|
35407 |
7979817 |
1 |
ClN2O4H13C17 |
AB2C4D13E17 |
-26.2 |
5.12 |
-8.96 |
-1.36 |
0 |
|
|
35408 |
7979818 |
1 |
SN2O5C17H18 |
AB2C5D17E18 |
-131.83 |
5.18 |
-8.9 |
-1.18 |
0 |
|
|
35409 |
7979819 |
1 |
ClNO6H12C16 |
ABC6D12E16 |
-102.23 |
10.64 |
-9.4 |
-1.26 |
0 |
|
|
35410 |
7979820 |
1 |
N2O5H20C22 |
A2B5C20D22 |
-99.66 |
3.57 |
-9.17 |
-0.63 |
0 |
|
|
35411 |
7979821 |
1 |
ClSN2O6H15C16 |
ABC2D6E15F16 |
-143.29 |
4.04 |
-8.68 |
-1.68 |
0 |
|
|
35412 |
7979823 |
1 |
ClSN2O6C17H17 |
ABC2D6E17F17 |
-144.51 |
3.65 |
-8.92 |
-1.82 |
0 |
|
|
35413 |
7979825 |
1 |
ClN2O4C20H23 |
AB2C4D20E23 |
-74.51 |
2.44 |
-9.45 |
-1.66 |
0 |
|
|
35414 |
7979826 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-151.69 |
3.17 |
-8.61 |
-0.42 |
0 |
|
|
35415 |
7979827 |
1 |
BrN3O4H14C15 |
AB3C4D14E15 |
-76.3 |
2.96 |
-9.18 |
-1.22 |
0 |
|
|
35416 |
7979828 |
1 |
ClNF2O5H12C16 |
ABC2D5E12F16 |
-187.21 |
2.87 |
-9.77 |
-1.66 |
0 |
|
|
35417 |
7979829 |
1 |
FNSO4C19H20 |
ABCD4E19F20 |
-177.8 |
2.87 |
-8.88 |
-0.71 |
0 |
|
|
35418 |
7979830 |
1 |
ClNF2O5H12C16 |
ABC2D5E12F16 |
-181.78 |
6.48 |
-9.75 |
-1.56 |
0 |
|
|
35419 |
7979831 |
1 |
N2O7C19H22 |
A2B7C19D22 |
-206.35 |
3.49 |
-8.95 |
-0.46 |
0 |
|
|
35420 |
7979833 |
1 |
ClN2O4C11H13 |
AB2C4D11E13 |
-85.81 |
2.69 |
-9.86 |
-1.74 |
0 |
|
|
35421 |
7979834 |
1 |
N2O4C19H22 |
A2B4C19D22 |
-109.31 |
1.01 |
-9.08 |
-0.51 |
0 |
|
|
35422 |
7979835 |
1 |
ClN2O4C12H15 |
AB2C4D12E15 |
-89.71 |
2.66 |
-9.86 |
-1.74 |
0 |
|
|
35423 |
7979836 |
1 |
N2O4C19H22 |
A2B4C19D22 |
-111.79 |
3.25 |
-9.1 |
-0.32 |
0 |
|
|
35424 |
7979837 |
1 |
ClN2O4C12H15 |
AB2C4D12E15 |
-89.81 |
2.41 |
-9.77 |
-1.63 |
0 |
|
|
35425 |
7979844 |
1 |
ClN2O4H17C18 |
AB2C4D17E18 |
-87.82 |
1.08 |
-9.06 |
-0.96 |
0 |
|
|
35426 |
7979845 |
1 |
ClN2O4C9H9 |
AB2C4D9E9 |
-69.06 |
2.57 |
-9.79 |
-1.64 |
0 |
|
|
35427 |
7979846 |
1 |
ClN2O4C17H17 |
AB2C4D17E17 |
-40.44 |
5.8 |
-8.9 |
-1.33 |
0 |
|
|
35428 |
7979847 |
1 |
N2O6H16C19 |
A2B6C16D19 |
-153.82 |
5.59 |
-9.04 |
-1.74 |
0 |
|
|
35429 |
7979848 |
1 |
ClN2O5H17C19 |
AB2C5D17E19 |
-62.04 |
5.76 |
-8.92 |
-1.32 |
0 |
|
|
35430 |
7979849 |
2 |
NO3C11H13 |
AB3C11D13 |
-191.11 |
3.2 |
-9.08 |
-0.53 |
0 |
|
|
35431 |
7979851 |
1 |
ClN3O4C14H16 |
AB3C4D14E16 |
-57.51 |
5.45 |
-9.82 |
-1.64 |
0 |
|
|
35432 |
7979860 |
1 |
ClN3O5C15H18 |
AB3C5D15E18 |
-128.19 |
6.11 |
-9.57 |
-1.41 |
0 |
|
|
35433 |
7979861 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-150.4 |
2.38 |
-9.03 |
-0.49 |
0 |
|
|
35434 |
7979862 |
1 |
ClN2O4C19H23 |
AB2C4D19E23 |
-101.02 |
3.03 |
-9.83 |
-1.77 |
0 |
|
|
35435 |
7979864 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-143.65 |
7.18 |
-8.75 |
-0.61 |
0 |
|
|
35436 |
7979865 |
1 |
ClN2O5C18H21 |
AB2C5D18E21 |
-95.19 |
8.5 |
-8.88 |
-1.52 |
0 |
|
|
35437 |
7979870 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-135.87 |
6.44 |
-9.28 |
-0.6 |
0 |
|
|
35438 |
7979873 |
1 |
ClN2O4C11H13 |
AB2C4D11E13 |
-81.28 |
1.79 |
-9.82 |
-1.74 |
0 |
|
|
35439 |
7979874 |
1 |
ClN2O4C15H19 |
AB2C4D15E19 |
-97.89 |
2.07 |
-9.82 |
-1.68 |
0 |
|
|
35440 |
7979875 |
1 |
ClN2O4C15H19 |
AB2C4D15E19 |
-96.49 |
2.56 |
-9.83 |
-1.74 |
0 |
|
|
35441 |
7979876 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-178.95 |
4.78 |
-9.4 |
-0.54 |
0 |
|
|
35442 |
7979877 |
1 |
ClN2O4C15H19 |
AB2C4D15E19 |
-97.73 |
2.76 |
-9.8 |
-1.74 |
0 |
|
|
35443 |
7979878 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-176.78 |
4.57 |
-9.43 |
-0.42 |
0 |
|
|
35444 |
7979879 |
1 |
ClN2O4C15H19 |
AB2C4D15E19 |
-97.14 |
2.62 |
-9.82 |
-1.74 |
0 |
|
|
35445 |
7979880 |
1 |
S2N3O4C19H23 |
A2B3C4D19E23 |
-121.69 |
6.81 |
-9.32 |
-0.71 |
0 |
|
|
35446 |
7979881 |
1 |
ClN2O6C19H21 |
AB2C6D19E21 |
-125.13 |
3.57 |
-8.37 |
-1.42 |
0 |
|
|
35447 |
7979882 |
1 |
SN3O5C19H23 |
AB3C5D19E23 |
-160.09 |
6.78 |
-9.13 |
-0.67 |
0 |
|
|
35448 |
7979883 |
1 |
ClN2O5H13C16 |
AB2C5D13E16 |
-84.47 |
5.52 |
-9.47 |
-1.45 |
0 |
|
|
35449 |
7979884 |
1 |
ClSN2O4H11C13 |
ABC2D4E11F13 |
-38.57 |
3.38 |
-9.44 |
-1.59 |
0 |