List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
168006 |
74911094 |
1 |
O2F3N7C25H26 |
A2B3C7D25E26 |
-141.34 |
6.36 |
-8.53 |
-1.25 |
0 |
|
|
168007 |
74911095 |
1 |
O2F3N7C25H26 |
A2B3C7D25E26 |
-141.02 |
4.56 |
-8.54 |
-1.31 |
0 |
|
|
168008 |
74911158 |
1 |
O3N4H18C20 |
A3B4C18D20 |
-33.04 |
2.44 |
-9.04 |
-0.6 |
0 |
|
|
168009 |
74911340 |
1 |
SO2N3C22H27 |
AB2C3D22E27 |
-65.37 |
2.4 |
-8.66 |
-0.19 |
0 |
|
|
168010 |
74911958 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-62.72 |
6.77 |
-8.94 |
-0.07 |
0 |
|
|
168011 |
74911965 |
2 |
NO2C8H9 |
AB2C8D9 |
-93.23 |
3.45 |
-9.15 |
-0.84 |
0 |
|
|
168012 |
74911966 |
1 |
N2O4C17H20 |
A2B4C17D20 |
-98.4 |
3.61 |
-9.15 |
-0.84 |
0 |
|
|
168013 |
74912290 |
1 |
FOSN3H12C18 |
ABCD3E12F18 |
46.12 |
2.8 |
-8.28 |
-1.6 |
0 |
|
|
168014 |
74912434 |
1 |
SO4N5C25H25 |
AB4C5D25E25 |
17.22 |
8.06 |
-8.33 |
-1.63 |
0 |
|
|
168015 |
74912908 |
1 |
NO3C25H29 |
AB3C25D29 |
-87.52 |
4.24 |
-8.5 |
-0.27 |
0 |
|
|
168016 |
74912909 |
1 |
ClNO3H20C21 |
ABC3D20E21 |
-74.81 |
5.79 |
-8.57 |
-0.33 |
0 |
|
|
168017 |
74912910 |
1 |
ClNO3H20C21 |
ABC3D20E21 |
-75.52 |
3.36 |
-8.5 |
-0.19 |
0 |
|
|
168018 |
74913047 |
1 |
NSO3C20H21 |
ABC3D20E21 |
-61.13 |
5.29 |
-8.48 |
-0.3 |
0 |
|
|
168019 |
74913079 |
1 |
SN2O4C26H26 |
AB2C4D26E26 |
-77.63 |
4.61 |
-8.5 |
-0.48 |
0 |
|
|
168020 |
74913621 |
1 |
ClN2O3C25H27 |
AB2C3D25E27 |
-59.84 |
2.36 |
-8.64 |
-0.72 |
0 |
|
|
168021 |
74913622 |
1 |
ClN2O5C26H27 |
AB2C5D26E27 |
-151.22 |
1.28 |
-8.88 |
-0.76 |
0 |
|
|
168022 |
74913623 |
1 |
ClNO3C26H28 |
ABC3D26E28 |
-79.55 |
2.47 |
-8.77 |
-0.72 |
0 |
|
|
168023 |
74913666 |
1 |
ClNO3C25H26 |
ABC3D25E26 |
-75.73 |
2.92 |
-8.77 |
-0.71 |
0 |
|
|
168024 |
74913972 |
1 |
BrNO3C24H24 |
ABC3D24E24 |
-55.56 |
3.8 |
-8.84 |
-0.71 |
0 |
|
|
168025 |
74914279 |
1 |
ClNO3H24C27 |
ABC3D24E27 |
-53.89 |
4.94 |
-8.52 |
-0.37 |
0 |
|
|
168026 |
74914300 |
1 |
NO5H27C28 |
AB5C27D28 |
-109.54 |
5.2 |
-8.3 |
-0.19 |
0 |
|
|
168027 |
74914301 |
1 |
NO5C30H31 |
AB5C30D31 |
-113.97 |
3.54 |
-8.26 |
-0.55 |
0 |
|
|
168028 |
74914381 |
2 |
NO2C15H15 |
AB2C15D15 |
-68.12 |
3.76 |
-7.85 |
-0.41 |
0 |
|
|
168029 |
74914642 |
1 |
N2O4H22C25 |
A2B4C22D25 |
-46.39 |
4.31 |
-8.61 |
-0.53 |
0 |
|
|
168030 |
74914643 |
2 |
NO2H13C15 |
AB2C13D15 |
-45.14 |
5.91 |
-8.69 |
-0.66 |
0 |
|
|
168031 |
74914644 |
2 |
NO2H13C15 |
AB2C13D15 |
-44.4 |
4.54 |
-8.65 |
-0.64 |
0 |
|
|
168032 |
74914722 |
1 |
FNO4H22C26 |
ABC4D22E26 |
-110.74 |
4.59 |
-8.76 |
-0.64 |
0 |
|
|
168033 |
74914787 |
1 |
NO4H25C27 |
AB4C25D27 |
-69.85 |
3.03 |
-8.62 |
-0.54 |
0 |
|
|
168034 |
74914788 |
1 |
NO4H25C27 |
AB4C25D27 |
-70.62 |
2.46 |
-8.51 |
-0.5 |
0 |
|
|
168035 |
74914789 |
1 |
NF3O5H22C27 |
AB3C5D22E27 |
-266.37 |
5.91 |
-8.71 |
-0.71 |
0 |
|
|
168036 |
74914790 |
2 |
NO2H14C15 |
AB2C14D15 |
-53.43 |
4.03 |
-8.5 |
-0.4 |
0 |
|
|
168037 |
74914794 |
1 |
N2O5H26C28 |
A2B5C26D28 |
-113.39 |
4.11 |
-8.32 |
-0.62 |
0 |
|
|
168038 |
74914914 |
1 |
FNO4H24C27 |
ABC4D24E27 |
-118.43 |
2.92 |
-8.81 |
-0.73 |
0 |
|
|
168039 |
74915018 |
1 |
N2O5C27H30 |
A2B5C27D30 |
-143.33 |
3.93 |
-8.27 |
-0.25 |
0 |
|
|
168040 |
74915125 |
1 |
NO5C24H27 |
AB5C24D27 |
-135.52 |
5.53 |
-8.49 |
-0.39 |
0 |
|
|
168041 |
74915126 |
1 |
SN2O4H24C28 |
AB2C4D24E28 |
-45.91 |
3.41 |
-8.55 |
-0.55 |
0 |
|
|
168042 |
74915127 |
1 |
NO4C21H21 |
AB4C21D21 |
-88.43 |
4.29 |
-8.55 |
-0.42 |
0 |
|
|
168043 |
74915128 |
1 |
NO6H25C28 |
AB6C25D28 |
-148.58 |
7.52 |
-8.7 |
-0.67 |
0 |
|
|
168044 |
74915169 |
1 |
N2O5C27H30 |
A2B5C27D30 |
-144.74 |
5.99 |
-8.33 |
-0.4 |
0 |
|
|
168045 |
74915170 |
1 |
NO4C24H25 |
AB4C24D25 |
-80.74 |
6.59 |
-8.58 |
-0.38 |
0 |
|
|
168046 |
74915837 |
1 |
N2O3H28C31 |
A2B3C28D31 |
-3.08 |
0.98 |
-8.01 |
-0.67 |
0 |
|
|
168047 |
74916367 |
1 |
NO3C18H23 |
AB3C18D23 |
-105.01 |
3.64 |
-8.46 |
-0.19 |
0 |
|
|
168048 |
74916970 |
1 |
NCl2O3H23C27 |
AB2C3D23E27 |
-59.92 |
8.81 |
-8.71 |
-0.53 |
0 |
|
|
168049 |
74916971 |
1 |
NCl2O3H23C27 |
AB2C3D23E27 |
-56.45 |
4.55 |
-8.75 |
-0.6 |
0 |
|
|
168050 |
74916972 |
1 |
ClNO3C27H30 |
ABC3D27E30 |
-92.45 |
7.07 |
-8.66 |
-0.48 |
0 |
|
|
168051 |
74917338 |
1 |
FNO3C27H30 |
ABC3D27E30 |
-128.56 |
6.24 |
-8.65 |
-0.39 |
0 |
|
|
168052 |
74917439 |
1 |
FN3O3C30H30 |
AB3C3D30E30 |
-65.46 |
3.08 |
-8.85 |
-0.55 |
0 |
|
|
168053 |
74917776 |
1 |
SN2O3H28C30 |
AB2C3D28E30 |
-32.79 |
3.75 |
-8.41 |
-0.49 |
0 |
|
|
168054 |
74917933 |
1 |
NO5C27H33 |
AB5C27D33 |
-164.44 |
4.73 |
-8.24 |
-0.21 |
0 |
|
|
168055 |
74917979 |
1 |
NO4H27C28 |
AB4C27D28 |
-80.13 |
4.81 |
-8.29 |
-0.34 |
0 |
|
|
168056 |
74917980 |
1 |
N2O4H30C31 |
A2B4C30D31 |
-63.99 |
5.91 |
-8.24 |
-0.22 |
0 |
|
|
168057 |
74917981 |
1 |
N2O5C27H30 |
A2B5C27D30 |
-146.78 |
9.12 |
-8.53 |
-0.47 |
0 |
|
|
168058 |
74918329 |
1 |
SN2O4H26C29 |
AB2C4D26E29 |
-45.1 |
3.11 |
-8.32 |
-0.65 |
0 |
|
|
168059 |
74918992 |
1 |
ClNO3H20C21 |
ABC3D20E21 |
-71.73 |
5.02 |
-8.95 |
-0.43 |
0 |
|
|
168060 |
74919045 |
1 |
NO3C23H25 |
AB3C23D25 |
-72.09 |
3.34 |
-8.59 |
-0.39 |
0 |
|
|
168061 |
74919046 |
1 |
NO3C23H25 |
AB3C23D25 |
-74.3 |
3.34 |
-8.53 |
-0.35 |
0 |
|
|
168062 |
74919047 |
1 |
NO5C23H29 |
AB5C23D29 |
-190.94 |
4.82 |
-8.56 |
-0.27 |
0 |
|
|
168063 |
74919048 |
1 |
NO5C23H29 |
AB5C23D29 |
-190.58 |
5.26 |
-8.34 |
-0.01 |
0 |
|
|
168064 |
74919049 |
1 |
N2O3C21H28 |
A2B3C21D28 |
-89.34 |
3.73 |
-8.49 |
-0.24 |
0 |
|
|
168065 |
74919803 |
1 |
SN2O5H24C26 |
AB2C5D24E26 |
-105.89 |
6.61 |
-8.86 |
-0.68 |
0 |
|
|
168066 |
74919829 |
1 |
ClN2O4H19C23 |
AB2C4D19E23 |
-31.33 |
3.87 |
-8.9 |
-0.55 |
0 |
|
|
168067 |
74919863 |
1 |
ClNO3C24H26 |
ABC3D24E26 |
-84.72 |
3.07 |
-8.72 |
-0.64 |
0 |
|
|
168068 |
74919971 |
1 |
NCl2O4C24H25 |
AB2C4D24E25 |
-123.11 |
3.79 |
-8.73 |
-0.8 |
0 |
|
|
168069 |
74920526 |
1 |
NO4C25H27 |
AB4C25D27 |
-102.69 |
4.16 |
-8.55 |
-0.43 |
0 |
|
|
168070 |
74920542 |
1 |
SN2O5H26C27 |
AB2C5D26E27 |
-115.64 |
4.9 |
-8.71 |
-0.6 |
0 |
|
|
168071 |
74920592 |
1 |
SN3O4C27H27 |
AB3C4D27E27 |
-81.76 |
8.09 |
-8.82 |
-0.69 |
0 |
|
|
168072 |
74920780 |
1 |
ClNO4H26C28 |
ABC4D26E28 |
-81.83 |
4.33 |
-8.48 |
-0.32 |
0 |
|
|
168073 |
74920781 |
1 |
ClNO4H26C28 |
ABC4D26E28 |
-80.63 |
2.86 |
-8.48 |
-0.41 |
0 |
|
|
168074 |
74920782 |
1 |
ClFNO4H23C27 |
ABCD4E23F27 |
-124.22 |
10.6 |
-8.72 |
-0.71 |
0 |
|
|
168075 |
74920848 |
1 |
NO5C30H31 |
AB5C30D31 |
-119.36 |
5.52 |
-8.49 |
-0.34 |
0 |
|
|
168076 |
74920956 |
1 |
NO4C28H33 |
AB4C28D33 |
-119.29 |
4.55 |
-8.83 |
-0.5 |
0 |
|
|
168077 |
74920988 |
1 |
NO4C29H29 |
AB4C29D29 |
-81.6 |
3.86 |
-8.56 |
-0.72 |
0 |
|
|
168078 |
74921120 |
1 |
ClFNO4H23C27 |
ABCD4E23F27 |
-123.66 |
4.4 |
-8.46 |
-0.43 |
0 |
|
|
168079 |
74921276 |
1 |
ClNO4H28C29 |
ABC4D28E29 |
-87.81 |
5.39 |
-8.62 |
-0.55 |
0 |
|
|
168080 |
74921417 |
1 |
NO5C28H35 |
AB5C28D35 |
-150.54 |
3.29 |
-8.22 |
-0.4 |
0 |
|
|
168081 |
74921514 |
1 |
NO5C24H27 |
AB5C24D27 |
-140.57 |
3.69 |
-8.24 |
-0.53 |
0 |
|
|
168082 |
74921515 |
1 |
NO5C30H31 |
AB5C30D31 |
-118.03 |
4.32 |
-8.4 |
-0.62 |
0 |
|
|
168083 |
74922096 |
1 |
N2O3C27H28 |
A2B3C27D28 |
-59.63 |
6.42 |
-8.33 |
-0.44 |
0 |
|
|
168084 |
74922252 |
1 |
N2O4C29H34 |
A2B4C29D34 |
-114.78 |
5.58 |
-8.52 |
-0.32 |
0 |
|
|
168085 |
74922257 |
3 |
NOC9H11 |
ABC9D11 |
-67.25 |
3.05 |
-8.53 |
-0.15 |
0 |
|
|
168086 |
74922377 |
1 |
NCl2O3C25H25 |
AB2C3D25E25 |
-96.01 |
3.43 |
-8.54 |
-0.47 |
0 |
|
|
168087 |
74922537 |
1 |
N2O3H26C30 |
A2B3C26D30 |
-9.51 |
2.61 |
-8.66 |
-0.6 |
0 |
|
|
168088 |
74922577 |
1 |
NCl2O3H23C27 |
AB2C3D23E27 |
-55.23 |
2.85 |
-8.88 |
-0.55 |
0 |
|
|
168089 |
74922578 |
1 |
NCl2O3H23C27 |
AB2C3D23E27 |
-57.14 |
3.99 |
-8.94 |
-0.57 |
0 |
|
|
168090 |
74922731 |
1 |
NCl2O3H25C28 |
AB2C3D25E28 |
-58.33 |
3.75 |
-8.77 |
-0.5 |
0 |
|
|
168091 |
74923618 |
1 |
NF2O4H25C28 |
AB2C4D25E28 |
-171.75 |
7.25 |
-8.59 |
-0.6 |
0 |
|
|
168092 |
74923619 |
1 |
NF2O4H27C29 |
AB2C4D27E29 |
-175.39 |
7.38 |
-8.41 |
-0.84 |
0 |
|
|
168093 |
74923620 |
1 |
NO4C24H27 |
AB4C24D27 |
-102.25 |
5.26 |
-8.56 |
-0.33 |
0 |
|
|
168094 |
74923621 |
1 |
N2O4C27H34 |
A2B4C27D34 |
-111.9 |
3.57 |
-8.65 |
-0.55 |
0 |
|
|
168095 |
74923622 |
1 |
NO4C30H31 |
AB4C30D31 |
-96.87 |
2.1 |
-8.56 |
-0.42 |
0 |
|
|
168096 |
74923623 |
1 |
NO4C30H31 |
AB4C30D31 |
-95.59 |
4.06 |
-8.52 |
-0.42 |
0 |
|
|
168097 |
74923624 |
1 |
NO4C30H31 |
AB4C30D31 |
-95.98 |
1.97 |
-8.39 |
-0.42 |
0 |
|
|
168098 |
74923625 |
1 |
NO4C30H31 |
AB4C30D31 |
-93.65 |
3.09 |
-8.62 |
-0.44 |
0 |
|
|
168099 |
74923626 |
1 |
NO4C30H31 |
AB4C30D31 |
-98.61 |
3.77 |
-8.58 |
-0.45 |
0 |
|
|
168100 |
74923627 |
2 |
NO2C13H16 |
AB2C13D16 |
-109.09 |
6.88 |
-8.41 |
-0.36 |
0 |
|
|
168101 |
74923693 |
1 |
N2O5C30H30 |
A2B5C30D30 |
-127.12 |
7.78 |
-8.59 |
-0.42 |
0 |
|
|
168102 |
74924253 |
1 |
NO3H29C32 |
AB3C29D32 |
-26.82 |
3.16 |
-8.6 |
-0.6 |
0 |
|
|
168103 |
74924254 |
1 |
NO3H29C32 |
AB3C29D32 |
-28.62 |
3.43 |
-8.47 |
-0.48 |
0 |
|
|
168104 |
74924255 |
1 |
NO5C16H17 |
AB5C16D17 |
-169.62 |
8.21 |
-9.02 |
-0.57 |
0 |
|
|
168105 |
74924256 |
1 |
NO5C17H19 |
AB5C17D19 |
-174.21 |
2.63 |
-8.7 |
-0.21 |
0 |