List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
301083 |
123059778 |
1 |
NO7C32H35 |
AB7C32D35 |
-204.95 |
7.03 |
-8.59 |
-1.06 |
0 |
|
|
301084 |
123059782 |
1 |
FNO6C32H34 |
ABC6D32E34 |
-223.92 |
12.71 |
-8.59 |
-1.14 |
0 |
|
|
301085 |
123059788 |
1 |
NO6C33H37 |
AB6C33D37 |
-180.82 |
6.9 |
-8.43 |
-0.93 |
0 |
|
|
301086 |
123059789 |
1 |
NO6C31H33 |
AB6C31D33 |
-174.86 |
4.24 |
-8.78 |
-1.12 |
0 |
|
|
301087 |
123059790 |
1 |
NF3O6H26C29 |
AB3C6D26E29 |
-324.36 |
7.87 |
-9.12 |
-1.26 |
0 |
|
|
301088 |
123059791 |
1 |
NF3O6H26C29 |
AB3C6D26E29 |
-327.57 |
8.91 |
-9.11 |
-1.35 |
0 |
|
|
301089 |
123059811 |
1 |
NO7H29C30 |
AB7C29D30 |
-203.17 |
6.02 |
-9.09 |
-1.2 |
0 |
|
|
301090 |
123059824 |
1 |
NO5H29C32 |
AB5C29D32 |
-100.6 |
6.92 |
-8.81 |
-1.02 |
0 |
|
|
301091 |
123059825 |
1 |
NO6C31H33 |
AB6C31D33 |
-171.72 |
4.33 |
-8.76 |
-1.11 |
0 |
|
|
301092 |
123059829 |
1 |
ClNO6H26C28 |
ABC6D26E28 |
-171.31 |
9.17 |
-8.79 |
-1.26 |
0 |
|
|
301093 |
123059831 |
1 |
NF3O5H26C29 |
AB3C5D26E29 |
-284.5 |
7.66 |
-9.05 |
-1.32 |
0 |
|
|
301094 |
123059833 |
1 |
ClNO7H26C28 |
ABC7D26E28 |
-202.73 |
8.48 |
-8.57 |
-1.17 |
0 |
|
|
301095 |
123059835 |
1 |
ClN2O6C29H29 |
AB2C6D29E29 |
-158.93 |
5.58 |
-7.84 |
-1.06 |
0 |
|
|
301096 |
123059836 |
1 |
ClNO6C30H30 |
ABC6D30E30 |
-178.89 |
3.96 |
-8.7 |
-1.22 |
0 |
|
|
301097 |
123059837 |
1 |
ClNO8H24C28 |
ABC8D24E28 |
-223.21 |
8.68 |
-8.35 |
-1.22 |
0 |
|
|
301098 |
123059838 |
1 |
ClFNO6H23C27 |
ABCD6E23F27 |
-208.51 |
10.07 |
-8.94 |
-1.28 |
0 |
|
|
301099 |
123059846 |
1 |
NCl2O6H25C28 |
AB2C6D25E28 |
-176.09 |
4.67 |
-9.12 |
-1.14 |
0 |
|
|
301100 |
123059856 |
1 |
ClNO6H26C28 |
ABC6D26E28 |
-170.71 |
5.67 |
-8.64 |
-1.11 |
0 |
|
|
301101 |
123059861 |
1 |
ClNO7H26C28 |
ABC7D26E28 |
-212.52 |
4.09 |
-8.68 |
-1.12 |
0 |
|
|
301102 |
123059867 |
1 |
ClNO6H28C29 |
ABC6D28E29 |
-183.27 |
7.81 |
-8.73 |
-1.28 |
0 |
|
|
301103 |
123059868 |
1 |
ClNF3O6H21C27 |
ABC3D6E21F27 |
-328.26 |
13.35 |
-9.11 |
-1.19 |
0 |
|
|
301104 |
123059870 |
1 |
ClNO7H26C28 |
ABC7D26E28 |
-209.82 |
7.5 |
-8.74 |
-1.02 |
0 |
|
|
301105 |
123059871 |
1 |
ClNO6H26C28 |
ABC6D26E28 |
-178.5 |
7.98 |
-8.68 |
-1.34 |
0 |
|
|
301106 |
123059874 |
1 |
ClN2O5C30H31 |
AB2C5D30E31 |
-141.5 |
7.11 |
-7.84 |
-1.12 |
0 |
|
|
301107 |
123059876 |
1 |
ClNO5H28C29 |
ABC5D28E29 |
-148.99 |
6.38 |
-8.7 |
-1.2 |
0 |
|
|
301108 |
123059899 |
1 |
ClN2O6H25C28 |
AB2C6D25E28 |
-172.93 |
14.01 |
-8.28 |
-0.82 |
0 |
|
|
301109 |
123059901 |
1 |
ClNO5H24C30 |
ABC5D24E30 |
-104.09 |
7.81 |
-8.74 |
-0.98 |
0 |
|
|
301110 |
123059903 |
1 |
NCl2O5H23C27 |
AB2C5D23E27 |
-144.74 |
5.31 |
-8.92 |
-1.28 |
0 |
|
|
301111 |
123059905 |
1 |
NCl2O6H21C26 |
AB2C6D21E26 |
-176.68 |
6.9 |
-8.87 |
-1.4 |
0 |
|
|
301112 |
123059909 |
1 |
NO5H31C33 |
AB5C31D33 |
-112.39 |
8.95 |
-8.59 |
-1.21 |
0 |
|
|
301113 |
123059914 |
1 |
N2O4H34C35 |
A2B4C34D35 |
-58.24 |
8.86 |
-7.76 |
-0.86 |
0 |
|
|
301114 |
123059915 |
2 |
NO2H16C17 |
AB2C16D17 |
-54.11 |
11.02 |
-7.67 |
-0.69 |
0 |
|
|
301115 |
123059916 |
2 |
NO2C17H17 |
AB2C17D17 |
-68.15 |
7.43 |
-7.79 |
-0.97 |
0 |
|
|
301116 |
123059933 |
1 |
BrNO4H24C30 |
ABC4D24E30 |
-49.31 |
10.71 |
-8.93 |
-0.95 |
0 |
|
|
301117 |
123059935 |
1 |
NF3O4H24C31 |
AB3C4D24E31 |
-215.91 |
7.49 |
-9.06 |
-1.23 |
0 |
|
|
301118 |
123059937 |
1 |
NO5H29C32 |
AB5C29D32 |
-103.77 |
8.34 |
-8.35 |
-1.1 |
0 |
|
|
301119 |
123059939 |
1 |
SN2O6H26C30 |
AB2C6D26E30 |
-128.42 |
11.71 |
-9.24 |
-1.15 |
0 |
|
|
301120 |
123059951 |
1 |
N3O4C31H33 |
A3B4C31D33 |
-68.13 |
6.94 |
-7.78 |
-0.89 |
0 |
|
|
301121 |
123059952 |
2 |
NO2C16H17 |
AB2C16D17 |
-83.73 |
7.34 |
-7.78 |
-1.03 |
0 |
|
|
301122 |
123059956 |
1 |
SN2O5H26C31 |
AB2C5D26E31 |
-80.39 |
10.55 |
-8.57 |
-0.92 |
0 |
|
|
301123 |
123059957 |
2 |
NO2H14C16 |
AB2C14D16 |
-41.35 |
8.72 |
-7.98 |
-0.86 |
0 |
|
|
301124 |
123059958 |
1 |
NO5H29C33 |
AB5C29D33 |
-93.86 |
6.4 |
-8.54 |
-1.22 |
0 |
|
|
301125 |
123059964 |
1 |
ClNF3O5H21C27 |
ABC3D5E21F27 |
-285.77 |
9.47 |
-9.17 |
-1.27 |
0 |
|
|
301126 |
123059968 |
1 |
ClN2O4C31H31 |
AB2C4D31E31 |
-91.29 |
7.4 |
-7.81 |
-0.88 |
0 |
|
|
301127 |
123059976 |
1 |
ClNO5C30H30 |
ABC5D30E30 |
-139.24 |
6.12 |
-8.5 |
-1.23 |
0 |
|
|
301128 |
123059978 |
1 |
NCl3O4H20C26 |
AB3C4D20E26 |
-96.11 |
10.11 |
-8.92 |
-1.21 |
0 |
|
|
301129 |
123059983 |
1 |
ClNO6H30C31 |
ABC6D30E31 |
-188.3 |
9.74 |
-8.66 |
-1.04 |
0 |
|
|
301130 |
123059989 |
1 |
ClNO6H28C30 |
ABC6D28E30 |
-180.64 |
9.34 |
-8.99 |
-1.09 |
0 |
|
|
301131 |
123059992 |
1 |
BrClNO4H21C26 |
ABCD4E21F26 |
-78.36 |
8.83 |
-9.07 |
-1.23 |
0 |
|
|
301132 |
123059998 |
1 |
ClNO5H28C29 |
ABC5D28E29 |
-132.84 |
4.99 |
-8.95 |
-1.14 |
0 |
|
|
301133 |
123059999 |
1 |
ClN2O4H27C32 |
AB2C4D27E32 |
-51.25 |
12.08 |
-8.08 |
-1.1 |
0 |
|
|
301134 |
123060005 |
1 |
ClN2O5H25C28 |
AB2C5D25E28 |
-133.06 |
10.47 |
-8.68 |
-1.2 |
0 |
|
|
301135 |
123060011 |
1 |
FN2O4C31H31 |
AB2C4D31E31 |
-129.49 |
5.36 |
-7.78 |
-0.81 |
0 |
|
|
301136 |
123060035 |
1 |
NO5C32H35 |
AB5C32D35 |
-140.04 |
8.82 |
-8.71 |
-1.17 |
0 |
|
|
301137 |
123060036 |
1 |
NF3O5H28C30 |
AB3C5D28E30 |
-296.96 |
7.25 |
-9.03 |
-1.28 |
0 |
|
|
301138 |
123060039 |
2 |
NO2C17H19 |
AB2C17D19 |
-97.3 |
8.27 |
-7.74 |
-0.88 |
0 |
|
|
301139 |
123060101 |
1 |
NO6C33H37 |
AB6C33D37 |
-176.57 |
6.83 |
-8.4 |
-1.14 |
0 |
|
|
301140 |
123060137 |
1 |
NO7C32H35 |
AB7C32D35 |
-200.55 |
10.19 |
-8.23 |
-0.86 |
0 |
|
|
301141 |
123060205 |
1 |
NO6C32H35 |
AB6C32D35 |
-167.83 |
6.81 |
-8.47 |
-1.07 |
0 |
|
|
301142 |
123060219 |
1 |
NO6C31H33 |
AB6C31D33 |
-163.6 |
7.27 |
-8.38 |
-1.17 |
0 |
|
|
301143 |
123060241 |
1 |
NO7C30H31 |
AB7C30D31 |
-188.47 |
8.7 |
-7.94 |
-1.03 |
0 |
|
|
301144 |
123060244 |
1 |
ClNO6H28C29 |
ABC6D28E29 |
-161.06 |
8.95 |
-8.33 |
-1.16 |
0 |
|
|
301145 |
123060245 |
1 |
ClFNO5H25C28 |
ABCD5E25F28 |
-169.48 |
10.86 |
-8.95 |
-1.13 |
0 |
|
|
301146 |
123060250 |
1 |
NO7C32H33 |
AB7C32D33 |
-214.02 |
8.27 |
-8.64 |
-0.86 |
0 |
|
|
301147 |
123060251 |
1 |
NO7H29C30 |
AB7C29D30 |
-199.81 |
11.48 |
-9.0 |
-1.09 |
0 |
|
|
301148 |
123060253 |
1 |
NO7C32H33 |
AB7C32D33 |
-216.64 |
9.72 |
-9.02 |
-1.3 |
0 |
|
|
301149 |
123060255 |
1 |
NO7C31H31 |
AB7C31D31 |
-206.2 |
8.21 |
-8.97 |
-1.18 |
0 |
|
|
301150 |
123060261 |
1 |
ClNO5H28C29 |
ABC5D28E29 |
-130.9 |
7.84 |
-8.88 |
-0.95 |
0 |
|
|
301151 |
123060266 |
1 |
NO6C31H33 |
AB6C31D33 |
-167.84 |
8.11 |
-8.2 |
-0.95 |
0 |
|
|
301152 |
123060273 |
1 |
BrNO5H26C28 |
ABC5D26E28 |
-110.92 |
8.65 |
-8.82 |
-1.12 |
0 |
|
|
301153 |
123060444 |
1 |
ClNO6H30C31 |
ABC6D30E31 |
-179.31 |
5.91 |
-9.26 |
-1.47 |
0 |
|
|
301154 |
123060445 |
1 |
ClNO6H30C31 |
ABC6D30E31 |
-175.94 |
4.81 |
-9.19 |
-1.23 |
0 |
|
|
301155 |
123060498 |
1 |
NO6C32H33 |
AB6C32D33 |
-180.19 |
8.38 |
-9.06 |
-1.33 |
0 |
|
|
301156 |
123060500 |
1 |
NO6C31H31 |
AB6C31D31 |
-169.1 |
9.35 |
-8.9 |
-1.02 |
0 |
|
|
301157 |
123060513 |
1 |
NO4H31C33 |
AB4C31D33 |
-65.1 |
7.68 |
-8.74 |
-0.73 |
0 |
|
|
301158 |
123060560 |
1 |
NO8C31H33 |
AB8C31D33 |
-223.22 |
7.29 |
-8.41 |
-0.54 |
0 |
|
|
301159 |
123060569 |
1 |
NF2O7H25C28 |
AB2C7D25E28 |
-266.83 |
8.23 |
-8.32 |
-1.27 |
0 |
|
|
301160 |
123060570 |
2 |
NO4C15H15 |
AB4C15D15 |
-229.71 |
11.07 |
-8.35 |
-1.24 |
0 |
|
|
301161 |
123060574 |
1 |
NO7C32H35 |
AB7C32D35 |
-211.43 |
6.59 |
-8.48 |
-0.87 |
0 |
|
|
301162 |
123060596 |
1 |
FNO7H28C29 |
ABC7D28E29 |
-227.33 |
7.08 |
-8.6 |
-0.75 |
0 |
|
|
301163 |
123067403 |
1 |
ClNO5H22C29 |
ABC5D22E29 |
-95.53 |
11.33 |
-8.74 |
-0.92 |
0 |
|
|
301164 |
123067407 |
1 |
NO5H27C35 |
AB5C27D35 |
-52.95 |
10.85 |
-8.7 |
-1.08 |
0 |
|
|
301165 |
123067409 |
1 |
N3O4C30H31 |
A3B4C30D31 |
-55.39 |
11.16 |
-7.8 |
-0.8 |
0 |
|
|
301166 |
123067413 |
1 |
NO6H29C30 |
AB6C29D30 |
-168.09 |
8.96 |
-8.95 |
-1.13 |
0 |
|
|
301167 |
123067429 |
1 |
ClN2O4C29H29 |
AB2C4D29E29 |
-85.51 |
5.67 |
-7.95 |
-1.0 |
0 |
|
|
301168 |
123067430 |
1 |
ClNO4H28C29 |
ABC4D28E29 |
-94.99 |
10.61 |
-8.5 |
-0.83 |
0 |
|
|
301169 |
123067431 |
1 |
ClNO6H22C27 |
ABC6D22E27 |
-143.88 |
9.78 |
-8.3 |
-0.84 |
0 |
|
|
301170 |
123067432 |
1 |
ClNO6H24C27 |
ABC6D24E27 |
-145.58 |
10.61 |
-8.01 |
-0.82 |
0 |
|
|
301171 |
123067435 |
1 |
ClNO5H28C29 |
ABC5D28E29 |
-129.97 |
6.39 |
-8.2 |
-0.84 |
0 |
|
|
301172 |
123067439 |
1 |
ClNO4H28C29 |
ABC4D28E29 |
-97.15 |
6.43 |
-8.61 |
-1.08 |
0 |
|
|
301173 |
123067444 |
1 |
ClNO6H24C28 |
ABC6D24E28 |
-165.21 |
12.52 |
-9.1 |
-1.06 |
0 |
|
|
301174 |
123068807 |
1 |
ClNO5H28C29 |
ABC5D28E29 |
-137.89 |
7.56 |
-8.16 |
-1.02 |
0 |
|
|
301175 |
123068854 |
1 |
NO6C31H33 |
AB6C31D33 |
-167.74 |
6.11 |
-7.97 |
-0.91 |
0 |
|
|
301176 |
123068873 |
1 |
NF3O4H28C30 |
AB3C4D28E30 |
-256.51 |
5.93 |
-9.12 |
-1.1 |
0 |
|
|
301177 |
123068877 |
1 |
SN2O6C29H30 |
AB2C6D29E30 |
-170.36 |
10.93 |
-9.28 |
-1.23 |
0 |
|
|
301178 |
123068899 |
1 |
NO7C29H29 |
AB7C29D29 |
-191.93 |
10.22 |
-8.3 |
-1.08 |
0 |
|
|
301179 |
123068919 |
1 |
NO6C30H31 |
AB6C30D31 |
-155.13 |
5.24 |
-8.39 |
-0.62 |
0 |
|
|
301180 |
123068948 |
1 |
NF3O6H26C29 |
AB3C6D26E29 |
-308.93 |
9.39 |
-8.76 |
-1.0 |
0 |
|
|
301181 |
123068953 |
1 |
NO7C32H35 |
AB7C32D35 |
-209.64 |
6.51 |
-8.41 |
-0.6 |
0 |
|
|
301182 |
123068954 |
2 |
NO3C16H18 |
AB3C16D18 |
-161.1 |
4.51 |
-7.8 |
-0.61 |
0 |