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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
32737 |
7847581 |
1 |
BrSN2O4C16H17 |
ABC2D4E16F17 |
-106.54 |
7.36 |
-9.53 |
-0.79 |
0 |
|
|
32738 |
7847617 |
1 |
BrNO2H14C17 |
ABC2D14E17 |
-12.53 |
2.94 |
-8.76 |
-0.41 |
0 |
|
|
32739 |
7847638 |
1 |
SN2O5C21H24 |
AB2C5D21E24 |
-179.34 |
8.23 |
-8.64 |
-0.69 |
0 |
|
|
32740 |
7847673 |
1 |
BrClNO2H13C15 |
ABCD2E13F15 |
-40.73 |
1.4 |
-9.38 |
-0.41 |
0 |
|
|
32741 |
7847709 |
1 |
ON3S3C17H21 |
AB3C3D17E21 |
40.18 |
4.89 |
-8.86 |
-1.27 |
0 |
|
|
32742 |
7847744 |
1 |
BrClNO2H15C16 |
ABCD2E15F16 |
-46.51 |
2.88 |
-9.4 |
-0.45 |
0 |
|
|
32743 |
7847760 |
1 |
OSCl2N3C16H17 |
ABC2D3E16F17 |
5.63 |
6.87 |
-9.19 |
-1.23 |
0 |
|
|
32744 |
7847786 |
1 |
SCl2N2O2C12H14 |
AB2C2D2E12F14 |
-93.57 |
4.17 |
-9.36 |
-1.2 |
0 |
|
|
32745 |
7847801 |
1 |
ClSN2O4H13C15 |
ABC2D4E13F15 |
-131.34 |
4.36 |
-9.4 |
-1.33 |
0 |
|
|
32746 |
7847804 |
1 |
OSCl2N2C14H16 |
ABC2D2E14F16 |
-21.54 |
4.07 |
-9.31 |
-1.16 |
0 |
|
|
32747 |
7847811 |
1 |
ClNSO2H10C14 |
ABCD2E10F14 |
-16.08 |
4.14 |
-9.51 |
-1.5 |
0 |
|
|
32748 |
7847813 |
1 |
ClSN2O4C17H17 |
ABC2D4E17F17 |
-142.88 |
3.58 |
-9.65 |
-1.55 |
0 |
|
|
32749 |
7847869 |
1 |
SCl2N2O4H14C16 |
AB2C2D4E14F16 |
-55.81 |
10.44 |
-9.12 |
-1.37 |
0 |
|
|
32750 |
7847919 |
1 |
ClNO5C21H28 |
ABC5D21E28 |
-199.06 |
2.24 |
-8.57 |
-0.81 |
0 |
|
|
32751 |
7847957 |
1 |
SN3O3C21H21 |
AB3C3D21E21 |
-47.74 |
2.69 |
-9.0 |
-1.44 |
0 |
|
|
32752 |
7847979 |
1 |
ClNO4H20C21 |
ABC4D20E21 |
-86.83 |
5.31 |
-9.4 |
-1.09 |
0 |
|
|
32753 |
7847984 |
1 |
NO4C21H25 |
AB4C21D25 |
-146.93 |
3.86 |
-8.76 |
-0.16 |
0 |
|
|
32754 |
7848001 |
1 |
NO5C17H25 |
AB5C17D25 |
-237.86 |
2.37 |
-9.48 |
-0.36 |
0 |
|
|
32755 |
7848011 |
1 |
N2O5C15H20 |
A2B5C15D20 |
-147.25 |
10.17 |
-9.48 |
-1.27 |
0 |
|
|
32756 |
7848039 |
1 |
N2O4C15H20 |
A2B4C15D20 |
-146.93 |
2.47 |
-9.58 |
-0.59 |
0 |
|
|
32757 |
7848055 |
1 |
ClNO5C20H26 |
ABC5D20E26 |
-200.98 |
5.66 |
-8.77 |
-1.07 |
0 |
|
|
32758 |
7848076 |
1 |
N2S2O6C17H20 |
A2B2C6D17E20 |
-226.87 |
10.9 |
-9.65 |
-1.67 |
0 |
|
|
32759 |
7848081 |
1 |
SN2O5C20H30 |
AB2C5D20E30 |
-227.63 |
5.99 |
-9.14 |
-0.43 |
0 |
|
|
32760 |
7848100 |
1 |
NO3C17H21 |
AB3C17D21 |
-111.8 |
3.96 |
-9.02 |
-0.55 |
0 |
|
|
32761 |
7848107 |
1 |
SN2O5H20C21 |
AB2C5D20E21 |
-150.94 |
4.66 |
-9.1 |
-1.46 |
0 |
|
|
32762 |
7848109 |
1 |
N2S2O3H14C18 |
A2B2C3D14E18 |
-45.82 |
3.43 |
-8.83 |
-1.1 |
0 |
|
|
32763 |
7848115 |
1 |
SN2O3C18H24 |
AB2C3D18E24 |
-124.44 |
3.58 |
-8.68 |
-0.75 |
0 |
|
|
32764 |
7848117 |
1 |
SN2O3C18H24 |
AB2C3D18E24 |
-118.36 |
6.44 |
-9.0 |
-0.74 |
0 |
|
|
32765 |
7848121 |
1 |
SN2O4C17H24 |
AB2C4D17E24 |
-192.47 |
6.38 |
-8.51 |
-0.57 |
0 |
|
|
32766 |
7848124 |
1 |
SF2N2O4H14C18 |
AB2C2D4E14F18 |
-206.72 |
3.67 |
-9.15 |
-1.54 |
0 |
|
|
32767 |
7848147 |
1 |
NO4C17H25 |
AB4C17D25 |
-178.51 |
4.38 |
-9.0 |
0.01 |
0 |
|
|
32768 |
7848153 |
1 |
Cl2N2O3C14H18 |
A2B2C3D14E18 |
-138.41 |
3.93 |
-9.33 |
-0.9 |
0 |
|
|
32769 |
7848155 |
1 |
Cl2N2O3C14H18 |
A2B2C3D14E18 |
-137.48 |
4.29 |
-9.17 |
-0.85 |
0 |
|
|
32770 |
7848178 |
1 |
O5C16H18 |
A5B16C18 |
-200.62 |
6.45 |
-9.42 |
-1.18 |
0 |
|
|
32771 |
7848181 |
1 |
SN3O5H17C20 |
AB3C5D17E20 |
-67.86 |
4.91 |
-9.01 |
-1.34 |
0 |
|
|
32772 |
7848209 |
1 |
SN2O5C16H24 |
AB2C5D16E24 |
-228.71 |
6.08 |
-8.99 |
-0.62 |
0 |
|
|
32773 |
7848212 |
1 |
SN2O4C17H22 |
AB2C4D17E22 |
-155.56 |
4.66 |
-9.49 |
-1.41 |
0 |
|
|
32774 |
7848239 |
1 |
N2O5C15H20 |
A2B5C15D20 |
-146.94 |
1.43 |
-9.65 |
-1.53 |
0 |
|
|
32775 |
7848251 |
1 |
N3O3C17H19 |
A3B3C17D19 |
-77.54 |
3.45 |
-9.52 |
-1.13 |
0 |
|
|
32776 |
7848256 |
1 |
BrSN2O3C15H17 |
ABC2D3E15F17 |
-93.34 |
6.62 |
-9.46 |
-1.13 |
0 |
|
|
32777 |
7848262 |
1 |
SN2O4C15H18 |
AB2C4D15E18 |
-147.17 |
5.98 |
-9.5 |
-1.46 |
0 |
|
|
32778 |
7848263 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-142.2 |
3.89 |
-8.71 |
-0.56 |
0 |
|
|
32779 |
7848271 |
1 |
SN2O3C17H22 |
AB2C3D17E22 |
-107.58 |
8.73 |
-9.24 |
-0.82 |
0 |
|
|
32780 |
7848288 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-99.48 |
5.36 |
-8.85 |
-0.94 |
0 |
|
|
32781 |
7848298 |
1 |
SN2O4C17H22 |
AB2C4D17E22 |
-154.73 |
5.11 |
-9.51 |
-1.47 |
0 |
|
|
32782 |
7848311 |
1 |
NO4C15H21 |
AB4C15D21 |
-172.51 |
3.18 |
-8.76 |
-0.1 |
0 |
|
|
32783 |
7848314 |
1 |
SN2O4C19H24 |
AB2C4D19E24 |
-158.17 |
4.64 |
-9.5 |
-1.45 |
0 |
|
|
32784 |
7848315 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-99.1 |
3.59 |
-9.36 |
-0.77 |
0 |
|
|
32785 |
7848323 |
1 |
NO4C15H21 |
AB4C15D21 |
-171.18 |
4.78 |
-8.34 |
-0.03 |
0 |
|
|
32786 |
7848398 |
1 |
N2F3O4C16H19 |
A2B3C4D16E19 |
-309.23 |
6.85 |
-9.28 |
-0.7 |
0 |
|
|
32787 |
7848428 |
1 |
N2O5C16H22 |
A2B5C16D22 |
-159.5 |
2.98 |
-9.38 |
-1.39 |
0 |
|
|
32788 |
7848441 |
1 |
NO6C17H21 |
AB6C17D21 |
-240.83 |
4.46 |
-8.86 |
-1.02 |
0 |
|
|
32789 |
7848454 |
1 |
NSCl2O4C18H19 |
ABC2D4E18F19 |
-149.98 |
5.65 |
-9.12 |
-0.47 |
0 |
|
|
32790 |
7848458 |
1 |
ClNSO5H16C19 |
ABCD5E16F19 |
-168.13 |
2.43 |
-9.16 |
-1.29 |
0 |
|
|
32791 |
7848459 |
1 |
SN2O4C13H14 |
AB2C4D13E14 |
-138.33 |
7.49 |
-9.58 |
-1.49 |
0 |
|
|
32792 |
7848471 |
1 |
Cl2O4H10C15 |
A2B4C10D15 |
-104.33 |
3.75 |
-9.28 |
-1.19 |
0 |
|
|
32793 |
7848481 |
1 |
Cl2N2O3C11H12 |
A2B2C3D11E12 |
-130.32 |
2.79 |
-9.83 |
-0.78 |
0 |
|
|
32794 |
7848482 |
1 |
Cl2N2O3C11H12 |
A2B2C3D11E12 |
-130.24 |
2.84 |
-9.84 |
-0.79 |
0 |
|
|
32795 |
7848490 |
1 |
Cl2N2O3H14C16 |
A2B2C3D14E16 |
-100.82 |
3.48 |
-9.41 |
-0.86 |
0 |
|
|
32796 |
7848496 |
1 |
ClSN2O4H17C19 |
ABC2D4E17F19 |
-120.23 |
7.95 |
-8.92 |
-1.56 |
0 |
|
|
32797 |
7848510 |
1 |
NCl2O2H15C16 |
AB2C2D15E16 |
-63.02 |
2.61 |
-8.95 |
-0.78 |
0 |
|
|
32798 |
7848515 |
1 |
FSN2O4C21H21 |
ABC2D4E21F21 |
-168.93 |
5.47 |
-9.49 |
-1.43 |
0 |
|
|
32799 |
7848530 |
1 |
NCl2O4H15C17 |
AB2C4D15E17 |
-123.58 |
2.05 |
-8.92 |
-0.74 |
0 |
|
|
32800 |
7848533 |
1 |
FSN3O6C15H18 |
ABC3D6E15F18 |
-257.3 |
2.53 |
-10.04 |
-0.85 |
0 |
|
|
32801 |
7848536 |
1 |
SN2O4H16C20 |
AB2C4D16E20 |
-72.96 |
1.38 |
-8.85 |
-1.16 |
0 |
|
|
32802 |
7848538 |
1 |
N2S2O3H18C21 |
A2B2C3D18E21 |
-36.79 |
3.86 |
-9.01 |
-1.23 |
0 |
|
|
32803 |
7848539 |
1 |
FNSO4H16C19 |
ABCD4E16F19 |
-148.2 |
6.0 |
-9.55 |
-1.44 |
0 |
|
|
32804 |
7848548 |
1 |
SN2O4H20C22 |
AB2C4D20E22 |
-97.21 |
2.26 |
-8.89 |
-1.03 |
0 |
|
|
32805 |
7848561 |
1 |
SN2O4C21H28 |
AB2C4D21E28 |
-169.48 |
5.5 |
-9.46 |
-1.39 |
0 |
|
|
32806 |
7848579 |
1 |
FNSO5C18H20 |
ABCD5E18F20 |
-209.27 |
4.32 |
-9.05 |
-0.81 |
0 |
|
|
32807 |
7848589 |
1 |
ClFNSO3H13C17 |
ABCDE3F13G17 |
-130.94 |
1.27 |
-8.79 |
-1.06 |
0 |
|
|
32808 |
7848595 |
1 |
FNSO5C21H24 |
ABCD5E21F24 |
-210.53 |
2.49 |
-9.39 |
-0.85 |
0 |
|
|
32809 |
7848599 |
1 |
FNSO4C17H18 |
ABCD4E17F18 |
-165.47 |
4.29 |
-9.85 |
-0.79 |
0 |
|
|
32810 |
7848600 |
1 |
FNSO4C17H18 |
ABCD4E17F18 |
-162.82 |
6.39 |
-9.65 |
-0.98 |
0 |
|
|
32811 |
7848602 |
1 |
FNSO4H14C18 |
ABCD4E14F18 |
-150.35 |
3.11 |
-8.85 |
-1.12 |
0 |
|
|
32812 |
7848603 |
1 |
ClFSN2O4H14C18 |
ABCD2E4F14G18 |
-169.41 |
6.67 |
-9.07 |
-1.46 |
0 |
|
|
32813 |
7848604 |
1 |
FSN2O5C20H25 |
ABC2D5E20F25 |
-225.67 |
10.15 |
-8.81 |
-0.75 |
0 |
|
|
32814 |
7848605 |
1 |
SN2O5H18C20 |
AB2C5D18E20 |
-145.21 |
6.86 |
-9.16 |
-1.65 |
0 |
|
|
32815 |
7848610 |
1 |
SN2O4C20H20 |
AB2C4D20E20 |
-101.33 |
1.38 |
-9.28 |
-1.14 |
0 |
|
|
32816 |
7848616 |
1 |
ClFNSO5H15C17 |
ABCDE5F15G17 |
-196.44 |
2.89 |
-9.78 |
-0.92 |
0 |
|
|
32817 |
7848617 |
1 |
SN2O4C20H20 |
AB2C4D20E20 |
-121.54 |
5.48 |
-8.49 |
-1.47 |
0 |
|
|
32818 |
7848627 |
1 |
FNSO6C19H22 |
ABCD6E19F22 |
-245.42 |
2.86 |
-8.13 |
-0.97 |
0 |
|
|
32819 |
7848637 |
1 |
SN2O4C22H24 |
AB2C4D22E24 |
-127.43 |
4.95 |
-8.6 |
-1.53 |
0 |
|
|
32820 |
7848649 |
1 |
FN2S2O5H15C17 |
AB2C2D5E15F17 |
-157.51 |
4.5 |
-9.02 |
-1.1 |
0 |
|
|
32821 |
7848664 |
1 |
ClFNSO5H17C18 |
ABCDE5F17G18 |
-200.96 |
3.04 |
-9.85 |
-1.02 |
0 |
|
|
32822 |
7848678 |
1 |
FSN2O5C15H21 |
ABC2D5E15F21 |
-245.42 |
8.01 |
-9.53 |
-0.59 |
0 |
|
|
32823 |
7848691 |
1 |
FNSO7H16C18 |
ABCD7E16F18 |
-251.29 |
6.34 |
-8.86 |
-1.01 |
0 |
|
|
32824 |
7848699 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-110.91 |
1.69 |
-9.22 |
-1.2 |
0 |
|
|
32825 |
7848712 |
1 |
SN2O4C20H26 |
AB2C4D20E26 |
-163.38 |
5.87 |
-9.5 |
-1.46 |
0 |
|
|
32826 |
7848715 |
1 |
FSN2O5C18H25 |
ABC2D5E18F25 |
-252.73 |
4.63 |
-9.9 |
-0.97 |
0 |
|
|
32827 |
7848735 |
1 |
FSN2O5C19H21 |
ABC2D5E19F21 |
-208.73 |
4.21 |
-9.66 |
-0.93 |
0 |
|
|
32828 |
7848743 |
1 |
FSN2O5C20H23 |
ABC2D5E20F23 |
-202.44 |
4.65 |
-9.57 |
-0.92 |
0 |
|
|
32829 |
7848749 |
1 |
FNSO5C20H22 |
ABCD5E20F22 |
-213.55 |
7.02 |
-9.45 |
-0.86 |
0 |
|
|
32830 |
7848758 |
1 |
FNSO5C20H22 |
ABCD5E20F22 |
-213.51 |
3.41 |
-9.48 |
-0.84 |
0 |
|
|
32831 |
7848759 |
1 |
SN2O4C20H20 |
AB2C4D20E20 |
-123.61 |
2.78 |
-9.11 |
-1.43 |
0 |
|
|
32832 |
7848760 |
1 |
FNSO5C20H22 |
ABCD5E20F22 |
-210.62 |
4.04 |
-9.49 |
-0.94 |
0 |
|
|
32833 |
7848761 |
1 |
N2S2O4H18C19 |
A2B2C4D18E19 |
-106.72 |
6.68 |
-8.78 |
-1.48 |
0 |
|
|
32834 |
7848778 |
1 |
FSN2O5C16H21 |
ABC2D5E16F21 |
-238.04 |
5.56 |
-9.64 |
-0.6 |
0 |
|
|
32835 |
7848790 |
1 |
FSN3O6C14H18 |
ABC3D6E14F18 |
-282.64 |
4.39 |
-10.04 |
-0.71 |
0 |
|
|
32836 |
7848800 |
1 |
SN3O5C20H25 |
AB3C5D20E25 |
-214.36 |
5.07 |
-9.26 |
-1.48 |
0 |