List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
324947 |
126678887 |
1 |
N6O12C27H52 |
A6B12C27D52 |
-567.2 |
9.53 |
-9.01 |
0.67 |
0 |
|
|
324948 |
126678890 |
1 |
ON5C14H25 |
AB5C14D25 |
-29.19 |
5.72 |
-8.46 |
0.24 |
0 |
|
|
324949 |
126678894 |
1 |
ClO3N6C22H25 |
AB3C6D22E25 |
-36.06 |
1.07 |
-9.0 |
-0.7 |
0 |
|
|
324950 |
126678896 |
1 |
ClO3N6C17H19 |
AB3C6D17E19 |
-19.51 |
8.55 |
-8.96 |
-0.9 |
0 |
|
|
324951 |
126678899 |
2 |
N2C5H11 |
A2B5C11 |
1.42 |
2.62 |
-8.74 |
1.22 |
0 |
|
|
324952 |
126678901 |
1 |
OF2N7H13C17 |
AB2C7D13E17 |
16.18 |
7.08 |
-8.89 |
-0.96 |
0 |
|
|
324953 |
126678904 |
1 |
F2O2N6H20C21 |
A2B2C6D20E21 |
-41.03 |
6.41 |
-8.9 |
-1.06 |
0 |
|
|
324954 |
126678915 |
1 |
O3F4N6H14C19 |
A3B4C6D14E19 |
-176.15 |
4.82 |
-9.01 |
-1.15 |
0 |
|
|
324955 |
126678918 |
1 |
ClO3N6C16H17 |
AB3C6D16E17 |
-23.97 |
2.66 |
-9.07 |
-1.0 |
0 |
|
|
324956 |
126678921 |
1 |
O3F4N6H18C19 |
A3B4C6D18E19 |
-218.76 |
3.59 |
-8.96 |
-1.02 |
0 |
|
|
324957 |
126678927 |
1 |
ClO3N5C17H22 |
AB3C5D17E22 |
-61.39 |
6.23 |
-8.27 |
-0.48 |
0 |
|
|
324958 |
126678929 |
1 |
FON5H14C18 |
ABC5D14E18 |
56.72 |
4.63 |
-8.95 |
-0.82 |
0 |
|
|
324959 |
126678936 |
1 |
FN3C21H22 |
AB3C21D22 |
0.54 |
4.08 |
-8.1 |
-0.03 |
0 |
|
|
324960 |
126678945 |
1 |
BrClSO2H12C14 |
ABCD2E12F14 |
-44.5 |
5.15 |
-9.59 |
-1.17 |
0 |
|
|
324961 |
126678946 |
1 |
ClO3N5C13H14 |
AB3C5D13E14 |
-51.14 |
3.76 |
-8.69 |
-1.29 |
0 |
|
|
324962 |
126678948 |
1 |
FN2C8H9 |
AB2C8D9 |
-0.04 |
3.99 |
-8.87 |
-0.36 |
0 |
|
|
324963 |
126678955 |
2 |
ON4H7C9 |
AB4C7D9 |
118.32 |
5.48 |
-9.06 |
-1.24 |
0 |
|
|
324964 |
126678958 |
2 |
ON2C12H13 |
AB2C12D13 |
8.53 |
4.69 |
-8.34 |
-0.9 |
0 |
|
|
324965 |
126678962 |
1 |
ON6C12H12 |
AB6C12D12 |
77.94 |
3.03 |
-9.06 |
-0.98 |
0 |
|
|
324966 |
126678973 |
1 |
F2O2N5H13C14 |
A2B2C5D13E14 |
-100.98 |
3.42 |
-8.47 |
-1.19 |
0 |
|
|
324967 |
126678975 |
1 |
OCl2N5H9C12 |
AB2C5D9E12 |
63.03 |
4.73 |
-8.94 |
-0.84 |
0 |
|
|
324968 |
126678978 |
1 |
O2F3N8H21C22 |
A2B3C8D21E22 |
-86.9 |
5.96 |
-8.73 |
-0.84 |
0 |
|
|
324969 |
126678980 |
1 |
FO2N6H19C20 |
AB2C6D19E20 |
5.84 |
2.44 |
-8.54 |
-0.77 |
0 |
|
|
324970 |
126678985 |
1 |
F3O3N7H20C22 |
A3B3C7D20E22 |
-131.59 |
4.98 |
-8.82 |
-1.04 |
0 |
|
|
324971 |
126678986 |
1 |
F3O3N6H13C18 |
A3B3C6D13E18 |
-142.04 |
2.46 |
-9.03 |
-1.11 |
0 |
|
|
324972 |
126678999 |
1 |
ON4H34C56 |
AB4C34D56 |
256.61 |
3.77 |
-7.91 |
-1.13 |
0 |
|
|
324973 |
126679000 |
1 |
ON2H30C52 |
AB2C30D52 |
232.49 |
0.33 |
-8.06 |
-1.1 |
0 |
|
|
324974 |
126679006 |
1 |
ON4H30C50 |
AB4C30D50 |
243.36 |
3.27 |
-8.25 |
-1.05 |
0 |
|
|
324975 |
126679007 |
1 |
ON2H30C52 |
AB2C30D52 |
217.96 |
1.73 |
-8.02 |
-1.17 |
0 |
|
|
324976 |
126679008 |
1 |
ON2H30C52 |
AB2C30D52 |
215.49 |
2.93 |
-7.87 |
-1.24 |
0 |
|
|
324977 |
126679011 |
1 |
ON4H30C50 |
AB4C30D50 |
228.18 |
4.07 |
-7.92 |
-1.14 |
0 |
|
|
324978 |
126679015 |
1 |
O2N5H13C14 |
A2B5C13D14 |
28.58 |
2.79 |
-9.06 |
-1.01 |
0 |
|
|
324979 |
126679024 |
1 |
ON4H30C50 |
AB4C30D50 |
231.99 |
6.12 |
-7.91 |
-1.18 |
0 |
|
|
324980 |
126679029 |
1 |
ON2H26C44 |
AB2C26D44 |
176.93 |
3.3 |
-7.92 |
-0.78 |
0 |
|
|
324981 |
126679033 |
1 |
ON4H30C50 |
AB4C30D50 |
228.6 |
6.42 |
-7.8 |
-1.28 |
0 |
|
|
324982 |
126679037 |
1 |
ON4H30C50 |
AB4C30D50 |
231.77 |
3.78 |
-7.89 |
-1.15 |
0 |
|
|
324983 |
126679054 |
1 |
ON2H30C52 |
AB2C30D52 |
224.75 |
2.6 |
-8.17 |
-1.11 |
0 |
|
|
324984 |
126679060 |
1 |
ON4H34C56 |
AB4C34D56 |
250.96 |
5.83 |
-7.88 |
-1.2 |
0 |
|
|
324985 |
126679066 |
1 |
ON4H28C48 |
AB4C28D48 |
229.72 |
4.39 |
-7.91 |
-1.07 |
0 |
|
|
324986 |
126679071 |
1 |
BrClNOH3C6 |
ABCDE3F6 |
42.92 |
2.31 |
-9.62 |
-1.85 |
0 |
|
|
324987 |
126679081 |
1 |
ON4H34C52 |
AB4C34D52 |
223.21 |
3.77 |
-7.93 |
-0.66 |
0 |
|
|
324988 |
126679088 |
1 |
ON5H41C57 |
AB5C41D57 |
246.79 |
4.81 |
-7.9 |
-0.55 |
0 |
|
|
324989 |
126679089 |
1 |
ON5H39C57 |
AB5C39D57 |
246.72 |
4.11 |
-8.02 |
-0.75 |
0 |
|
|
324990 |
126679091 |
1 |
ON4H32C54 |
AB4C32D54 |
245.62 |
2.64 |
-7.99 |
-1.14 |
0 |
|
|
324991 |
126679096 |
1 |
ON2H22C36 |
AB2C22D36 |
139.57 |
0.96 |
-7.78 |
-0.78 |
0 |
|
|
324992 |
126679105 |
1 |
ON3H27C49 |
AB3C27D49 |
217.7 |
3.56 |
-8.08 |
-1.32 |
0 |
|
|
324993 |
126679109 |
1 |
ON2H22C36 |
AB2C22D36 |
150.49 |
4.31 |
-7.96 |
-0.68 |
0 |
|
|
324994 |
126679116 |
1 |
ON4H32C54 |
AB4C32D54 |
246.25 |
4.13 |
-8.01 |
-1.15 |
0 |
|
|
324995 |
126679119 |
1 |
ON4H32C54 |
AB4C32D54 |
255.15 |
3.94 |
-8.15 |
-1.2 |
0 |
|
|
324996 |
126679121 |
1 |
ON2H22C36 |
AB2C22D36 |
140.28 |
1.75 |
-7.88 |
-0.77 |
0 |
|
|
324997 |
126679128 |
1 |
ON4H32C54 |
AB4C32D54 |
254.51 |
5.05 |
-7.91 |
-1.34 |
0 |
|
|
324998 |
126679131 |
1 |
ON2H22C36 |
AB2C22D36 |
252.04 |
0.63 |
-7.87 |
-0.78 |
0 |
|
|
324999 |
126679150 |
1 |
ON4H30C50 |
AB4C30D50 |
234.45 |
3.93 |
-7.86 |
-1.18 |
0 |
|
|
325000 |
126679159 |
1 |
ON4H30C50 |
AB4C30D50 |
244.26 |
3.52 |
-8.04 |
-1.06 |
0 |
|
|
325001 |
126679163 |
1 |
ON4H34C56 |
AB4C34D56 |
249.06 |
4.86 |
-7.86 |
-1.2 |
0 |
|
|
325002 |
126679165 |
1 |
ON4H30C50 |
AB4C30D50 |
237.78 |
3.74 |
-7.86 |
-1.09 |
0 |
|
|
325003 |
126679170 |
1 |
ON4H30C50 |
AB4C30D50 |
233.9 |
3.71 |
-7.95 |
-1.07 |
0 |
|
|
325004 |
126679175 |
1 |
ON4H34C56 |
AB4C34D56 |
265.99 |
3.74 |
-8.02 |
-1.03 |
0 |
|
|
325005 |
126679178 |
1 |
ON4H30C50 |
AB4C30D50 |
241.5 |
3.85 |
-7.9 |
-1.11 |
0 |
|
|
325006 |
126679185 |
1 |
ON5H37C51 |
AB5C37D51 |
209.64 |
5.06 |
-7.93 |
-0.62 |
0 |
|
|
325007 |
126679192 |
1 |
ClF2N5H8C12 |
AB2C5D8E12 |
12.55 |
4.09 |
-9.08 |
-1.0 |
0 |
|
|
325008 |
126679210 |
1 |
ClPO4N8C42H44 |
ABC4D8E42F44 |
-47.49 |
9.04 |
-8.86 |
-0.76 |
0 |
|
|
325009 |
126679214 |
1 |
F3N5H12C13 |
A3B5C12D13 |
-67.67 |
4.35 |
-8.42 |
-0.58 |
0 |
|
|
325010 |
126679220 |
1 |
BrNO2H10C18 |
ABC2D10E18 |
75.2 |
1.64 |
-9.04 |
-1.56 |
0 |
|
|
325011 |
126679224 |
1 |
ON2H28C44 |
AB2C28D44 |
171.85 |
2.16 |
-7.84 |
-1.18 |
0 |
|
|
325012 |
126679225 |
2 |
NOH13C21 |
ABC13D21 |
134.97 |
3.27 |
-7.93 |
-0.83 |
0 |
|
|
325013 |
126679227 |
1 |
FON6H29C46 |
ABC6D29E46 |
184.0 |
5.02 |
-8.09 |
-1.23 |
0 |
|
|
325014 |
126679228 |
1 |
ON3H21C37 |
AB3C21D37 |
173.13 |
5.55 |
-8.2 |
-1.05 |
0 |
|
|
325015 |
126679234 |
1 |
ON2H32C54 |
AB2C32D54 |
209.07 |
1.83 |
-7.98 |
-0.77 |
0 |
|
|
325016 |
126679238 |
1 |
ON3H29C48 |
AB3C29D48 |
200.21 |
2.92 |
-7.82 |
-0.63 |
0 |
|
|
325017 |
126679252 |
1 |
SH2C5O5F6 |
AB2C5D5E6 |
-493.48 |
2.62 |
-11.57 |
-2.1 |
0 |
|
|
325018 |
126679254 |
1 |
ON2H30C52 |
AB2C30D52 |
218.37 |
3.53 |
-7.9 |
-1.25 |
0 |
|
|
325019 |
126679259 |
1 |
ON4H32C54 |
AB4C32D54 |
248.84 |
4.41 |
-7.97 |
-1.13 |
0 |
|
|
325020 |
126679262 |
1 |
ON4H34C56 |
AB4C34D56 |
250.83 |
5.95 |
-7.83 |
-1.21 |
0 |
|
|
325021 |
126679271 |
1 |
ON4H34C56 |
AB4C34D56 |
254.94 |
6.49 |
-7.81 |
-1.29 |
0 |
|
|
325022 |
126679284 |
1 |
ON2H28C50 |
AB2C28D50 |
324.06 |
4.21 |
-8.05 |
-1.33 |
0 |
|
|
325023 |
126679290 |
1 |
ON2H28C50 |
AB2C28D50 |
211.82 |
3.62 |
-8.02 |
-1.22 |
0 |
|
|
325024 |
126679295 |
1 |
ON2H34C58 |
AB2C34D58 |
226.44 |
2.1 |
-7.98 |
-0.78 |
0 |
|
|
325025 |
126679298 |
1 |
ON2H28C50 |
AB2C28D50 |
212.65 |
1.81 |
-8.1 |
-1.19 |
0 |
|
|
325026 |
126679302 |
1 |
ON4H32C54 |
AB4C32D54 |
252.02 |
5.08 |
-8.02 |
-1.15 |
0 |
|
|
325027 |
126679304 |
1 |
ON2H28C50 |
AB2C28D50 |
211.67 |
3.56 |
-8.01 |
-1.25 |
0 |
|
|
325028 |
126679310 |
1 |
SN3C18H25 |
AB3C18D25 |
43.38 |
1.95 |
-8.39 |
-0.21 |
0 |
|
|
325029 |
126679311 |
1 |
ON5H35C51 |
AB5C35D51 |
226.21 |
3.06 |
-8.01 |
-0.88 |
0 |
|
|
325030 |
126679314 |
1 |
ON5H37C51 |
AB5C37D51 |
224.57 |
5.03 |
-7.98 |
-0.72 |
0 |
|
|
325031 |
126679315 |
1 |
ON5H37C51 |
AB5C37D51 |
219.36 |
4.69 |
-7.82 |
-0.76 |
0 |
|
|
325032 |
126679318 |
1 |
ON5H35C51 |
AB5C35D51 |
222.38 |
4.07 |
-7.82 |
-1.05 |
0 |
|
|
325033 |
126679319 |
1 |
ON5H37C51 |
AB5C37D51 |
218.91 |
6.02 |
-7.9 |
-0.8 |
0 |
|
|
325034 |
126679323 |
1 |
ON5H37C51 |
AB5C37D51 |
300.81 |
4.64 |
-7.89 |
-0.59 |
0 |
|
|
325035 |
126679325 |
1 |
ON5H35C51 |
AB5C35D51 |
221.38 |
3.84 |
-8.05 |
-0.7 |
0 |
|
|
325036 |
126679332 |
1 |
ON2H28C50 |
AB2C28D50 |
211.07 |
3.98 |
-7.91 |
-1.27 |
0 |
|
|
325037 |
126679336 |
1 |
ON4H30C52 |
AB4C30D52 |
242.05 |
4.1 |
-7.9 |
-1.08 |
0 |
|
|
325038 |
126679338 |
1 |
ON2H28C50 |
AB2C28D50 |
222.31 |
1.77 |
-8.04 |
-1.14 |
0 |
|
|
325039 |
126679342 |
1 |
ON4H32C54 |
AB4C32D54 |
245.25 |
6.47 |
-7.83 |
-1.22 |
0 |
|
|
325040 |
126679343 |
1 |
ON4H30C52 |
AB4C30D52 |
245.03 |
5.19 |
-7.92 |
-1.1 |
0 |
|
|
325041 |
126679352 |
1 |
ON4H32C54 |
AB4C32D54 |
245.21 |
3.68 |
-7.96 |
-1.14 |
0 |
|
|
325042 |
126679358 |
1 |
N3O3H21C25 |
A3B3C21D25 |
20.93 |
5.56 |
-8.66 |
-0.84 |
0 |
|
|
325043 |
126679359 |
1 |
ON2H28C50 |
AB2C28D50 |
216.4 |
1.92 |
-7.91 |
-1.09 |
0 |
|
|
325044 |
126679361 |
1 |
ON2H28C50 |
AB2C28D50 |
208.31 |
3.37 |
-7.85 |
-1.23 |
0 |
|
|
325045 |
126679363 |
1 |
ON4H30C48 |
AB4C30D48 |
218.98 |
4.26 |
-7.92 |
-1.1 |
0 |
|
|
325046 |
126679384 |
1 |
ON4H34C56 |
AB4C34D56 |
425.87 |
2.6 |
-7.96 |
-0.67 |
0 |