| | COMPOUND: C19235 | |
Entry |
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Name |
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Formula |
C16H8N2O4
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Exact mass |
292.0484
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Mol weight |
292.2457
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Structure |
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Other DBs |
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KCF data |
ATOM 22
1 C8y C 21.4200 -20.7900
2 C8y C 21.4200 -22.1900
3 C8y C 23.8449 -22.1900
4 C8y C 23.8449 -20.7900
5 C8y C 22.6324 -20.0900
6 C8x C 25.0573 -22.8900
7 C8x C 26.2697 -22.1900
8 C8x C 26.2697 -20.7900
9 C8y C 25.0573 -20.0900
10 C8x C 20.2076 -20.0900
11 C8y C 18.9951 -20.7900
12 C8x C 18.9951 -22.1900
13 C8x C 20.2076 -22.8900
14 C8y C 25.0573 -18.6900
15 C8x C 23.8449 -17.9900
16 C8x C 22.6324 -18.6900
17 N2b N 26.2718 -17.9888 #+
18 O3a O 27.4683 -18.6798 #-
19 O3a O 26.2718 -16.5902
20 N2b N 17.7640 -20.0790 #+
21 O3a O 16.2788 -20.7747 #-
22 O3a O 17.7643 -18.6901
BOND 25
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 3 6 2
7 6 7 1
8 7 8 2
9 8 9 1
10 4 9 2
11 1 10 2
12 10 11 1
13 11 12 2
14 12 13 1
15 2 13 2
16 9 14 1
17 14 15 2
18 15 16 1
19 5 16 2
20 14 17 1
21 17 18 1
22 17 19 2
23 11 20 1
24 20 21 1
25 20 22 2
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