List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
63651 |
26758878 |
1 |
N2O5H20C23 |
A2B5C20D23 |
-133.86 |
3.11 |
-8.79 |
-0.8 |
0 |
|
|
63652 |
26758879 |
1 |
N2O5H20C23 |
A2B5C20D23 |
-132.2 |
4.23 |
-8.77 |
-0.96 |
0 |
|
|
63653 |
26758881 |
1 |
N2O5H18C21 |
A2B5C18D21 |
-145.63 |
4.15 |
-8.94 |
-1.33 |
0 |
|
|
63654 |
26758883 |
1 |
NSO6H19C21 |
ABC6D19E21 |
-180.01 |
10.97 |
-9.22 |
-1.27 |
0 |
|
|
63655 |
26758884 |
1 |
NSO6H19C21 |
ABC6D19E21 |
-182.37 |
4.03 |
-8.89 |
-1.05 |
0 |
|
|
63656 |
26758885 |
1 |
N2O4C23H26 |
A2B4C23D26 |
-107.97 |
2.85 |
-8.7 |
-0.89 |
0 |
|
|
63657 |
26758890 |
1 |
ClNO4H20C22 |
ABC4D20E22 |
-116.37 |
5.64 |
-9.04 |
-1.18 |
0 |
|
|
63658 |
26758893 |
1 |
NO4C23H23 |
AB4C23D23 |
-124.06 |
6.9 |
-8.54 |
-1.27 |
0 |
|
|
63659 |
26758895 |
1 |
N2O7H20C22 |
A2B7C20D22 |
-145.38 |
7.03 |
-8.86 |
-1.41 |
0 |
|
|
63660 |
26758896 |
1 |
NSO6C19H21 |
ABC6D19E21 |
-226.12 |
3.32 |
-9.02 |
-1.21 |
0 |
|
|
63661 |
26758897 |
1 |
NSO6C19H21 |
ABC6D19E21 |
-219.61 |
5.69 |
-9.01 |
-1.21 |
0 |
|
|
63662 |
26758899 |
1 |
NSO6C19H21 |
ABC6D19E21 |
-221.21 |
7.23 |
-9.08 |
-1.29 |
0 |
|
|
63663 |
26758900 |
1 |
NO4C23H23 |
AB4C23D23 |
-121.45 |
4.75 |
-8.37 |
-0.99 |
0 |
|
|
63664 |
26758905 |
1 |
NO5H21C22 |
AB5C21D22 |
-143.48 |
3.99 |
-8.24 |
-1.02 |
0 |
|
|
63665 |
26758906 |
1 |
FNO4H18C21 |
ABC4D18E21 |
-152.11 |
7.78 |
-9.1 |
-1.29 |
0 |
|
|
63666 |
26758907 |
1 |
FNO4H18C21 |
ABC4D18E21 |
-152.96 |
7.09 |
-9.04 |
-1.2 |
0 |
|
|
63667 |
26758910 |
1 |
ClNO4H20C22 |
ABC4D20E22 |
-123.27 |
5.88 |
-8.93 |
-1.17 |
0 |
|
|
63668 |
26758911 |
1 |
ClNO4H20C22 |
ABC4D20E22 |
-122.88 |
5.91 |
-8.85 |
-1.19 |
0 |
|
|
63669 |
26758917 |
1 |
NO4C19H23 |
AB4C19D23 |
-149.51 |
4.93 |
-8.96 |
-1.07 |
0 |
|
|
63670 |
26758918 |
1 |
ClFNO4H17C21 |
ABCD4E17F21 |
-158.92 |
6.11 |
-8.98 |
-1.22 |
0 |
|
|
63671 |
26758919 |
1 |
ClFNO4H17C21 |
ABCD4E17F21 |
-157.32 |
5.91 |
-8.94 |
-1.2 |
0 |
|
|
63672 |
26758924 |
1 |
ClN2O4H17C20 |
AB2C4D17E20 |
-99.72 |
3.82 |
-9.05 |
-1.22 |
0 |
|
|
63673 |
26758925 |
1 |
ClN2O4H17C20 |
AB2C4D17E20 |
-99.98 |
5.24 |
-9.04 |
-1.2 |
0 |
|
|
63674 |
26758927 |
1 |
NF2O4H17C21 |
AB2C4D17E21 |
-196.35 |
6.36 |
-9.06 |
-1.22 |
0 |
|
|
63675 |
26758930 |
1 |
BrFNO4H17C21 |
ABCD4E17F21 |
-148.29 |
5.21 |
-9.15 |
-1.25 |
0 |
|
|
63676 |
26758937 |
1 |
NO6C23H23 |
AB6C23D23 |
-180.65 |
6.17 |
-8.09 |
-1.21 |
0 |
|
|
63677 |
26758945 |
1 |
ClNO5H20C22 |
ABC5D20E22 |
-151.76 |
7.76 |
-8.33 |
-1.18 |
0 |
|
|
63678 |
26758946 |
1 |
NO5C23H23 |
AB5C23D23 |
-147.36 |
8.28 |
-8.96 |
-1.1 |
0 |
|
|
63679 |
26758947 |
1 |
NO5C23H23 |
AB5C23D23 |
-145.69 |
6.41 |
-8.94 |
-1.08 |
0 |
|
|
63680 |
26758962 |
1 |
NO4C21H25 |
AB4C21D25 |
-142.22 |
5.31 |
-8.94 |
-1.07 |
0 |
|
|
63681 |
26758964 |
1 |
N2O4C25H26 |
A2B4C25D26 |
-95.95 |
4.37 |
-8.39 |
-1.1 |
0 |
|
|
63682 |
26758967 |
1 |
NSO6C20H23 |
ABC6D20E23 |
-216.82 |
5.92 |
-9.07 |
-1.21 |
0 |
|
|
63683 |
26758968 |
1 |
NSO6C20H23 |
ABC6D20E23 |
-216.05 |
8.8 |
-9.17 |
-1.28 |
0 |
|
|
63684 |
26758969 |
1 |
NSO6C20H23 |
ABC6D20E23 |
-215.2 |
8.58 |
-9.04 |
-1.23 |
0 |
|
|
63685 |
26758970 |
1 |
NO4C21H27 |
AB4C21D27 |
-155.29 |
6.93 |
-8.95 |
-1.06 |
0 |
|
|
63686 |
26758974 |
1 |
NSO6C21H25 |
ABC6D21E25 |
-226.3 |
4.04 |
-8.97 |
-0.98 |
0 |
|
|
63687 |
26758975 |
1 |
NSO6C21H25 |
ABC6D21E25 |
-223.0 |
6.48 |
-8.89 |
-1.07 |
0 |
|
|
63688 |
26758977 |
1 |
N2O5H22C23 |
A2B5C22D23 |
-151.47 |
5.28 |
-9.01 |
-1.18 |
0 |
|
|
63689 |
26758978 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-194.67 |
6.36 |
-8.84 |
-0.94 |
0 |
|
|
63690 |
26758979 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-201.67 |
4.0 |
-8.98 |
-1.17 |
0 |
|
|
63691 |
26758981 |
1 |
N2O5C19H22 |
A2B5C19D22 |
-193.75 |
2.44 |
-9.0 |
-1.07 |
0 |
|
|
63692 |
26758982 |
1 |
N2O7H22C24 |
A2B7C22D24 |
-220.1 |
3.75 |
-8.38 |
-0.97 |
0 |
|
|
63693 |
26758983 |
1 |
N2O7H22C24 |
A2B7C22D24 |
-223.43 |
4.29 |
-8.3 |
-1.18 |
0 |
|
|
63694 |
26758984 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-192.22 |
4.81 |
-9.02 |
-1.08 |
0 |
|
|
63695 |
26758988 |
1 |
SN2O4H14C19 |
AB2C4D14E19 |
-14.9 |
4.36 |
-8.95 |
-1.11 |
0 |
|
|
63696 |
26758989 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-154.49 |
6.3 |
-7.66 |
-0.86 |
0 |
|
|
63697 |
26758996 |
1 |
ClO5C17H17 |
AB5C17D17 |
-161.0 |
4.56 |
-8.67 |
-0.52 |
0 |
|
|
63698 |
26758997 |
1 |
N2F3O6C14H15 |
A2B3C6D14E15 |
-384.32 |
4.99 |
-9.0 |
-1.01 |
0 |
|
|
63699 |
26759000 |
1 |
N2O5C20H26 |
A2B5C20D26 |
-162.79 |
2.99 |
-8.74 |
-0.57 |
0 |
|
|
63700 |
26759001 |
1 |
N2O5C20H26 |
A2B5C20D26 |
-164.36 |
3.34 |
-8.73 |
-0.68 |
0 |
|
|
63701 |
26759003 |
1 |
ClNO5C18H18 |
ABC5D18E18 |
-167.2 |
6.64 |
-8.93 |
-0.86 |
0 |
|
|
63702 |
26759009 |
1 |
BrNO5C18H18 |
ABC5D18E18 |
-156.51 |
9.94 |
-9.06 |
-0.97 |
0 |
|
|
63703 |
26759011 |
1 |
NO6C19H21 |
AB6C19D21 |
-197.58 |
5.72 |
-8.19 |
-0.85 |
0 |
|
|
63704 |
26759012 |
1 |
NO6C19H21 |
AB6C19D21 |
-197.42 |
9.52 |
-8.29 |
-0.86 |
0 |
|
|
63705 |
26759016 |
1 |
NF3O5H18C19 |
AB3C5D18E19 |
-317.85 |
4.79 |
-8.9 |
-0.86 |
0 |
|
|
63706 |
26759017 |
1 |
NO5C16H23 |
AB5C16D23 |
-199.02 |
2.05 |
-8.7 |
-0.58 |
0 |
|
|
63707 |
26759019 |
1 |
NO5C16H23 |
AB5C16D23 |
-209.83 |
8.15 |
-8.91 |
-0.78 |
0 |
|
|
63708 |
26759020 |
1 |
NO5C21H25 |
AB5C21D25 |
-176.01 |
8.45 |
-8.65 |
-0.86 |
0 |
|
|
63709 |
26759023 |
1 |
ClFNO5H17C18 |
ABCD5E17F18 |
-214.92 |
9.5 |
-8.99 |
-1.01 |
0 |
|
|
63710 |
26759024 |
1 |
ClFNO5H17C18 |
ABCD5E17F18 |
-211.35 |
8.6 |
-8.94 |
-0.96 |
0 |
|
|
63711 |
26759025 |
1 |
ClFNO5H17C18 |
ABCD5E17F18 |
-207.85 |
7.3 |
-8.99 |
-0.9 |
0 |
|
|
63712 |
26759028 |
1 |
NO6C21H25 |
AB6C21D25 |
-208.29 |
8.49 |
-8.71 |
-0.84 |
0 |
|
|
63713 |
26759030 |
1 |
NO6C21H25 |
AB6C21D25 |
-206.38 |
7.04 |
-8.67 |
-0.78 |
0 |
|
|
63714 |
26759031 |
1 |
FSN3O4C24H26 |
ABC3D4E24F26 |
-135.54 |
9.3 |
-8.38 |
-0.86 |
0 |
|
|
63715 |
26759034 |
1 |
NF2O5H17C18 |
AB2C5D17E18 |
-247.49 |
6.13 |
-8.94 |
-0.91 |
0 |
|
|
63716 |
26759037 |
1 |
SN3O4C25H29 |
AB3C4D25E29 |
-95.17 |
6.57 |
-8.26 |
-0.43 |
0 |
|
|
63717 |
26759038 |
1 |
NF2O5H17C18 |
AB2C5D17E18 |
-249.7 |
5.8 |
-8.94 |
-0.85 |
0 |
|
|
63718 |
26759043 |
1 |
ClNO5C19H20 |
ABC5D19E20 |
-169.95 |
5.62 |
-8.83 |
-0.71 |
0 |
|
|
63719 |
26759044 |
1 |
NF2O5H17C18 |
AB2C5D17E18 |
-246.61 |
5.6 |
-8.9 |
-0.84 |
0 |
|
|
63720 |
26759046 |
1 |
NF2O5H17C18 |
AB2C5D17E18 |
-251.08 |
9.95 |
-9.03 |
-1.02 |
0 |
|
|
63721 |
26759047 |
1 |
NF2O5H17C18 |
AB2C5D17E18 |
-249.9 |
9.44 |
-9.05 |
-1.01 |
0 |
|
|
63722 |
26759048 |
1 |
NO7C20H23 |
AB7C20D23 |
-229.04 |
1.53 |
-8.14 |
-0.56 |
0 |
|
|
63723 |
26759049 |
1 |
NO7C20H23 |
AB7C20D23 |
-233.74 |
3.96 |
-7.98 |
-0.82 |
0 |
|
|
63724 |
26759050 |
1 |
ClNF3O5H17C19 |
ABC3D5E17F19 |
-327.95 |
5.92 |
-8.95 |
-0.92 |
0 |
|
|
63725 |
26759051 |
1 |
ClNF3O5H17C19 |
ABC3D5E17F19 |
-326.44 |
5.79 |
-8.95 |
-0.94 |
0 |
|
|
63726 |
26759052 |
1 |
FNO5C19H20 |
ABC5D19E20 |
-214.85 |
9.25 |
-8.81 |
-0.87 |
0 |
|
|
63727 |
26759053 |
1 |
FNO5C19H20 |
ABC5D19E20 |
-213.67 |
9.12 |
-8.77 |
-0.88 |
0 |
|
|
63728 |
26759055 |
1 |
NO5C19H27 |
AB5C19D27 |
-208.39 |
6.47 |
-8.82 |
-0.73 |
0 |
|
|
63729 |
26759057 |
1 |
NO6C20H23 |
AB6C20D23 |
-199.32 |
8.08 |
-8.82 |
-0.72 |
0 |
|
|
63730 |
26759058 |
1 |
SF2N2O4C18H18 |
AB2C2D4E18F18 |
-208.53 |
7.85 |
-9.38 |
-1.27 |
0 |
|
|
63731 |
26759059 |
1 |
NO6C20H23 |
AB6C20D23 |
-199.92 |
7.47 |
-8.81 |
-0.67 |
0 |
|
|
63732 |
26759060 |
1 |
FNO5C19H20 |
ABC5D19E20 |
-208.59 |
9.23 |
-8.94 |
-0.83 |
0 |
|
|
63733 |
26759061 |
1 |
FNO5C19H20 |
ABC5D19E20 |
-208.58 |
7.72 |
-8.89 |
-0.84 |
0 |
|
|
63734 |
26759062 |
1 |
SN2O5C21H26 |
AB2C5D21E26 |
-167.27 |
10.82 |
-9.12 |
-0.58 |
0 |
|
|
63735 |
26759065 |
1 |
SN2O5C22H24 |
AB2C5D22E24 |
-152.98 |
8.78 |
-9.09 |
-0.64 |
0 |
|
|
63736 |
26759067 |
1 |
SN2O5C24H26 |
AB2C5D24E26 |
-150.8 |
10.71 |
-9.12 |
-0.71 |
0 |
|
|
63737 |
26759069 |
1 |
NO5C20H23 |
AB5C20D23 |
-173.23 |
8.27 |
-8.94 |
-0.82 |
0 |
|
|
63738 |
26759070 |
1 |
NO5C20H23 |
AB5C20D23 |
-172.71 |
4.28 |
-8.85 |
-0.81 |
0 |
|
|
63739 |
26759071 |
1 |
NF2O6C19H19 |
AB2C6D19E19 |
-304.79 |
5.82 |
-8.81 |
-0.75 |
0 |
|
|
63740 |
26759072 |
1 |
NF2O6C19H19 |
AB2C6D19E19 |
-305.05 |
4.63 |
-8.88 |
-0.82 |
0 |
|
|
63741 |
26759073 |
1 |
SN2O5C22H24 |
AB2C5D22E24 |
-138.28 |
0.89 |
-8.74 |
-0.69 |
0 |
|
|
63742 |
26759074 |
1 |
SN2O5C22H24 |
AB2C5D22E24 |
-142.45 |
7.39 |
-8.88 |
-0.91 |
0 |
|
|
63743 |
26759075 |
1 |
NO5C20H23 |
AB5C20D23 |
-170.86 |
8.25 |
-8.89 |
-0.77 |
0 |
|
|
63744 |
26759077 |
1 |
NO6C20H21 |
AB6C20D21 |
-202.32 |
6.66 |
-8.7 |
-0.66 |
0 |
|
|
63745 |
26759079 |
1 |
SN2O6C17H18 |
AB2C6D17E18 |
-190.39 |
4.8 |
-8.82 |
-0.77 |
0 |
|
|
63746 |
26759080 |
1 |
SN2O6C17H18 |
AB2C6D17E18 |
-204.55 |
6.81 |
-8.76 |
-0.71 |
0 |
|
|
63747 |
26759082 |
1 |
SN4O6C22H30 |
AB4C6D22E30 |
-250.01 |
12.5 |
-9.04 |
-0.59 |
0 |
|
|
63748 |
26759088 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-149.61 |
5.31 |
-8.09 |
-0.74 |
0 |
|
|
63749 |
26759090 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-149.31 |
0.98 |
-8.39 |
-0.56 |
0 |
|
|
63750 |
26759107 |
2 |
NO3C9H12 |
AB3C9D12 |
-244.9 |
2.68 |
-8.84 |
-0.74 |
0 |