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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
74352 |
48421759 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-134.23 |
2.85 |
-9.68 |
-0.02 |
0 |
|
|
74353 |
48421760 |
1 |
N2O4C19H22 |
A2B4C19D22 |
-129.7 |
1.22 |
-8.93 |
0.07 |
0 |
|
|
74354 |
48421763 |
1 |
NO4C15H25 |
AB4C15D25 |
-181.2 |
4.84 |
-9.19 |
0.67 |
0 |
|
|
74355 |
48421764 |
2 |
NOC7H10 |
ABC7D10 |
-52.54 |
4.38 |
-9.74 |
-0.18 |
0 |
|
|
74356 |
48421765 |
1 |
ClNO2C15H20 |
ABC2D15E20 |
-72.47 |
4.28 |
-9.34 |
-0.1 |
0 |
|
|
74357 |
48421766 |
1 |
NO2C14H25 |
AB2C14D25 |
-104.31 |
3.26 |
-9.66 |
1.17 |
0 |
|
|
74358 |
48421768 |
1 |
NCl2O2C14H17 |
AB2C2D14E17 |
-75.58 |
3.42 |
-9.59 |
-0.5 |
0 |
|
|
74359 |
48421769 |
1 |
N2O5C19H26 |
A2B5C19D26 |
-218.29 |
3.12 |
-9.27 |
0.42 |
0 |
|
|
74360 |
48421770 |
3 |
NOC6H7 |
ABC6D7 |
-87.35 |
3.39 |
-9.4 |
-0.21 |
0 |
|
|
74361 |
48421771 |
1 |
ClN2O3C19H21 |
AB2C3D19E21 |
-107.47 |
1.08 |
-9.36 |
-0.1 |
0 |
|
|
74362 |
48421772 |
1 |
N2O3C18H26 |
A2B3C18D26 |
-135.35 |
1.96 |
-9.35 |
0.32 |
0 |
|
|
74363 |
48421775 |
1 |
NO4C17H23 |
AB4C17D23 |
-123.13 |
6.0 |
-8.92 |
-0.19 |
0 |
|
|
74364 |
48421776 |
1 |
N2O3C21H26 |
A2B3C21D26 |
-110.68 |
6.75 |
-9.47 |
-0.02 |
0 |
|
|
74365 |
48421777 |
1 |
NO2C17H25 |
AB2C17D25 |
-77.52 |
3.38 |
-9.24 |
0.24 |
0 |
|
|
74366 |
48421778 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-108.56 |
2.35 |
-9.18 |
0.06 |
0 |
|
|
74367 |
48421780 |
1 |
FNO2C15H20 |
ABC2D15E20 |
-112.76 |
3.27 |
-9.75 |
-0.3 |
0 |
|
|
74368 |
48421781 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-152.53 |
7.48 |
-8.94 |
-0.23 |
0 |
|
|
74369 |
48421782 |
1 |
NO2C18H27 |
AB2C18D27 |
-81.92 |
3.65 |
-9.17 |
0.32 |
0 |
|
|
74370 |
48421783 |
1 |
FN2O3C19H21 |
AB2C3D19E21 |
-143.36 |
3.4 |
-9.53 |
-0.19 |
0 |
|
|
74371 |
48421784 |
1 |
FNO2C15H20 |
ABC2D15E20 |
-109.36 |
1.31 |
-9.53 |
-0.18 |
0 |
|
|
74372 |
48421785 |
1 |
NO2C17H25 |
AB2C17D25 |
-81.01 |
3.16 |
-9.07 |
0.19 |
0 |
|
|
74373 |
48421786 |
1 |
F2N2O3C19H20 |
A2B2C3D19E20 |
-192.88 |
2.35 |
-9.73 |
-0.47 |
0 |
|
|
74374 |
48421787 |
1 |
NF2O2C15H19 |
AB2C2D15E19 |
-156.97 |
2.46 |
-9.76 |
-0.37 |
0 |
|
|
74375 |
48421788 |
1 |
NO2F3C16H20 |
AB2C3D16E20 |
-225.51 |
5.36 |
-9.82 |
-0.61 |
0 |
|
|
74376 |
48421789 |
1 |
N2O3C21H26 |
A2B3C21D26 |
-117.82 |
2.1 |
-9.05 |
0.13 |
0 |
|
|
74377 |
48421790 |
1 |
N2F3O3C20H21 |
A2B3C3D20E21 |
-260.73 |
5.02 |
-9.88 |
-0.75 |
0 |
|
|
74378 |
48421791 |
1 |
FN2O3C19H21 |
AB2C3D19E21 |
-145.96 |
2.87 |
-9.6 |
-0.25 |
0 |
|
|
74379 |
48421792 |
1 |
F2N2O3C19H20 |
A2B2C3D19E20 |
-190.12 |
2.33 |
-9.8 |
-0.54 |
0 |
|
|
74380 |
48421794 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-100.57 |
3.63 |
-9.4 |
-0.04 |
0 |
|
|
74381 |
48421795 |
1 |
NO2C15H21 |
AB2C15D21 |
-65.64 |
3.77 |
-9.2 |
0.27 |
0 |
|
|
74382 |
48421796 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-102.42 |
2.97 |
-9.36 |
0.1 |
0 |
|
|
74383 |
48421797 |
1 |
NO2C16H23 |
AB2C16D23 |
-66.52 |
3.61 |
-9.34 |
0.37 |
0 |
|
|
74384 |
48421798 |
1 |
N2O5C21H26 |
A2B5C21D26 |
-171.93 |
2.97 |
-8.21 |
0.08 |
0 |
|
|
74385 |
48421801 |
1 |
NO2C18H27 |
AB2C18D27 |
-81.28 |
3.63 |
-9.3 |
0.19 |
0 |
|
|
74386 |
48421802 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-166.81 |
2.36 |
-8.43 |
0.04 |
0 |
|
|
74387 |
48421803 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-30.54 |
2.87 |
-8.89 |
-0.27 |
0 |
|
|
74388 |
48421804 |
1 |
NO4C16H23 |
AB4C16D23 |
-132.47 |
2.92 |
-8.38 |
0.14 |
0 |
|
|
74389 |
48421805 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-37.7 |
3.36 |
-8.58 |
0.07 |
0 |
|
|
74390 |
48421806 |
1 |
NO3C15H21 |
AB3C15D21 |
-94.19 |
3.1 |
-8.97 |
-0.02 |
0 |
|
|
74391 |
48421807 |
1 |
NO2C13H23 |
AB2C13D23 |
-96.14 |
3.28 |
-9.23 |
0.96 |
0 |
|
|
74392 |
48421808 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-131.81 |
2.76 |
-8.5 |
0.13 |
0 |
|
|
74393 |
48421809 |
2 |
NOC7H14 |
ABC7D14 |
-94.45 |
2.33 |
-8.59 |
1.0 |
0 |
|
|
74394 |
48421812 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-132.5 |
2.63 |
-9.33 |
0.11 |
0 |
|
|
74395 |
48421813 |
2 |
NO2C8H12 |
AB2C8D12 |
-170.44 |
2.78 |
-9.6 |
0.08 |
0 |
|
|
74396 |
48421814 |
1 |
NO3C12H23 |
AB3C12D23 |
-136.19 |
2.35 |
-9.62 |
1.11 |
0 |
|
|
74397 |
48421815 |
1 |
N3O5C19H27 |
A3B5C19D27 |
-220.29 |
3.54 |
-9.48 |
0.04 |
0 |
|
|
74398 |
48421816 |
1 |
N2O4C15H26 |
A2B4C15D26 |
-189.06 |
3.02 |
-9.77 |
0.73 |
0 |
|
|
74399 |
48421817 |
1 |
NO2C16H27 |
AB2C16D27 |
-105.13 |
3.45 |
-9.22 |
0.9 |
0 |
|
|
74400 |
48421818 |
1 |
N2O3C23H24 |
A2B3C23D24 |
-79.58 |
1.93 |
-9.0 |
-0.62 |
0 |
|
|
74401 |
48421819 |
1 |
NO2C19H23 |
AB2C19D23 |
-45.81 |
3.02 |
-8.78 |
-0.42 |
0 |
|
|
74402 |
48421820 |
1 |
NO3C16H23 |
AB3C16D23 |
-103.58 |
4.09 |
-8.91 |
0.1 |
0 |
|
|
74403 |
48421822 |
1 |
N2O3C15H26 |
A2B3C15D26 |
-130.39 |
6.05 |
-9.15 |
0.99 |
0 |
|
|
74404 |
48421823 |
1 |
SN2O3C17H20 |
AB2C3D17E20 |
-92.65 |
3.36 |
-9.07 |
-0.08 |
0 |
|
|
74405 |
48421824 |
1 |
N2O4C17H26 |
A2B4C17D26 |
-179.4 |
2.53 |
-9.6 |
0.15 |
0 |
|
|
74406 |
48421825 |
1 |
NO3C13H25 |
AB3C13D25 |
-147.25 |
3.88 |
-9.51 |
1.24 |
0 |
|
|
74407 |
48421826 |
1 |
NSO2C13H19 |
ABC2D13E19 |
-57.13 |
2.55 |
-9.08 |
-0.08 |
0 |
|
|
74408 |
48421828 |
1 |
N3O4C19H27 |
A3B4C19D27 |
-167.42 |
2.21 |
-9.32 |
0.1 |
0 |
|
|
74409 |
48421829 |
1 |
N2O3C15H26 |
A2B3C15D26 |
-135.28 |
1.42 |
-9.17 |
0.49 |
0 |
|
|
74410 |
48421830 |
1 |
N2O4C17H20 |
A2B4C17D20 |
-129.47 |
2.68 |
-9.35 |
-0.18 |
0 |
|
|
74411 |
48421832 |
1 |
N2O5C18H24 |
A2B5C18D24 |
-210.42 |
2.44 |
-9.4 |
0.19 |
0 |
|
|
74412 |
48421833 |
1 |
NO4C14H23 |
AB4C14D23 |
-175.98 |
3.15 |
-9.35 |
0.57 |
0 |
|
|
74413 |
48421834 |
1 |
FN2O3C19H21 |
AB2C3D19E21 |
-144.01 |
1.03 |
-9.52 |
-0.18 |
0 |
|
|
74414 |
48421835 |
1 |
FNO2C15H20 |
ABC2D15E20 |
-110.02 |
2.2 |
-9.49 |
-0.13 |
0 |
|
|
74415 |
48421836 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-103.81 |
2.19 |
-9.65 |
-0.25 |
0 |
|
|
74416 |
48421837 |
2 |
NO2C9H14 |
AB2C9D14 |
-180.74 |
1.59 |
-9.45 |
0.07 |
0 |
|
|
74417 |
48421839 |
1 |
SN2O3C16H18 |
AB2C3D16E18 |
-85.56 |
2.62 |
-9.16 |
-0.29 |
0 |
|
|
74418 |
48421840 |
1 |
NO2C15H21 |
AB2C15D21 |
-65.56 |
3.22 |
-9.37 |
0.15 |
0 |
|
|
74419 |
48421842 |
2 |
NO2C10H12 |
AB2C10D12 |
-135.23 |
4.03 |
-9.04 |
-0.04 |
0 |
|
|
74420 |
48421843 |
1 |
FN2O3C18H19 |
AB2C3D18E19 |
-140.56 |
3.66 |
-9.56 |
-0.04 |
0 |
|
|
74421 |
48421844 |
1 |
NSO2C12H17 |
ABC2D12E17 |
-51.09 |
3.02 |
-9.3 |
-0.43 |
0 |
|
|
74422 |
48421845 |
1 |
NO2C18H23 |
AB2C18D23 |
-43.72 |
2.68 |
-9.33 |
0.13 |
0 |
|
|
74423 |
48421847 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-103.94 |
3.66 |
-9.29 |
0.18 |
0 |
|
|
74424 |
48421848 |
1 |
NO2C16H23 |
AB2C16D23 |
-64.79 |
3.6 |
-9.27 |
0.29 |
0 |
|
|
74425 |
48421851 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-98.32 |
1.49 |
-9.48 |
-0.01 |
0 |
|
|
74426 |
48421852 |
1 |
N2O3C22H24 |
A2B3C22D24 |
-78.57 |
1.94 |
-9.35 |
0.1 |
0 |
|
|
74427 |
48421854 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-57.82 |
3.06 |
-9.54 |
0.14 |
0 |
|
|
74428 |
48421860 |
1 |
ClNSO2C13H18 |
ABCD2E13F18 |
-53.51 |
2.68 |
-9.2 |
-0.39 |
0 |
|
|
74429 |
48421861 |
1 |
SN3O4C20H23 |
AB3C4D20E23 |
-118.87 |
2.17 |
-9.33 |
-0.66 |
0 |
|
|
74430 |
48421862 |
1 |
SN2O3C16H22 |
AB2C3D16E22 |
-83.19 |
5.03 |
-9.28 |
-0.72 |
0 |
|
|
74431 |
48421864 |
1 |
N3O3C17H29 |
A3B3C17D29 |
-123.76 |
4.97 |
-8.91 |
0.72 |
0 |
|
|
74432 |
48421867 |
1 |
FN2O3C19H21 |
AB2C3D19E21 |
-144.51 |
3.53 |
-9.54 |
-0.05 |
0 |
|
|
74433 |
48421869 |
1 |
NO3C15H23 |
AB3C15D23 |
-107.41 |
2.71 |
-9.2 |
0.61 |
0 |
|
|
74434 |
48421872 |
1 |
NO4C17H25 |
AB4C17D25 |
-134.31 |
3.5 |
-8.41 |
-0.07 |
0 |
|
|
74435 |
48421873 |
1 |
NSO2C14H21 |
ABC2D14E21 |
-55.32 |
3.31 |
-8.93 |
-0.2 |
0 |
|
|
74436 |
48421874 |
2 |
N2O2C10H15 |
A2B2C10D15 |
-170.86 |
3.48 |
-9.2 |
0.14 |
0 |
|
|
74437 |
48421875 |
1 |
N3O3C16H29 |
A3B3C16D29 |
-135.24 |
2.79 |
-8.95 |
0.61 |
0 |
|
|
74438 |
48421876 |
1 |
N2O5C21H26 |
A2B5C21D26 |
-163.56 |
4.34 |
-8.41 |
-0.01 |
0 |
|
|
74439 |
48421879 |
1 |
FNO3C16H22 |
ABC3D16E22 |
-134.32 |
4.11 |
-8.96 |
-0.1 |
0 |
|
|
74440 |
48421881 |
1 |
SN2O2C16H24 |
AB2C2D16E24 |
-46.43 |
2.94 |
-8.81 |
0.03 |
0 |
|
|
74441 |
48421882 |
1 |
N4O4C19H28 |
A4B4C19D28 |
-154.67 |
5.53 |
-8.94 |
0.06 |
0 |
|
|
74442 |
48421886 |
1 |
FSN2O3C20H23 |
ABC2D3E20F23 |
-142.3 |
0.3 |
-8.68 |
-0.22 |
0 |
|
|
74443 |
48421888 |
1 |
FN2O4C20H23 |
AB2C4D20E23 |
-174.13 |
4.43 |
-8.93 |
-0.08 |
0 |
|
|
74444 |
48421889 |
1 |
ClN2O4C19H21 |
AB2C4D19E21 |
-140.61 |
5.2 |
-8.93 |
-0.17 |
0 |
|
|
74445 |
48421890 |
2 |
NOC7H10 |
ABC7D10 |
-52.99 |
5.27 |
-9.76 |
-0.22 |
0 |
|
|
74446 |
48421891 |
1 |
NO4C16H21 |
AB4C16D21 |
-119.06 |
2.94 |
-8.73 |
-0.11 |
0 |
|
|
74447 |
48421892 |
1 |
N3O4C15H21 |
A3B4C15D21 |
-160.02 |
2.0 |
-9.75 |
-0.05 |
0 |
|
|
74448 |
48421893 |
1 |
N2O3C11H20 |
A2B3C11D20 |
-123.34 |
4.71 |
-9.48 |
0.5 |
0 |
|
|
74449 |
48421894 |
1 |
FNSO2C16H22 |
ABCD2E16F22 |
-107.43 |
2.78 |
-8.78 |
-0.26 |
0 |
|
|
74450 |
48421895 |
1 |
SN2O3C21H26 |
AB2C3D21E26 |
-105.23 |
4.08 |
-8.64 |
0.06 |
0 |
|
|
74451 |
48421896 |
1 |
NSO2C17H25 |
ABC2D17E25 |
-67.42 |
3.33 |
-8.85 |
-0.01 |
0 |