COMPOUND: C14599
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Entry
C14599 Compound
Name
2,3,3-Triphenylacrylonitrile;
Triphenylcyanoethylene
Formula
C21H15N
Exact mass
281.1204
Mol weight
281.3505
Structure
Mol file
KCF file
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Other DBs
CAS:
6304-33-2
PubChem:
17395599
ChEBI:
34217
NIKKAJI:
J33.777C
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KCF data
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ATOM 22
1 C2c C 23.4198 -17.0731
2 C2c C 23.4315 -18.4577
3 C8y C 22.1814 -16.3370
4 C8y C 24.6991 -16.3255
5 C8y C 22.2282 -19.1704
6 C8x C 22.1755 -14.9526
7 C8x C 20.9779 -17.0440
8 C8x C 24.6993 -14.9877
9 C8x C 25.9143 -17.0614
10 C8x C 21.0189 -18.4810
11 C8x C 22.2456 -20.5490
12 C8x C 20.9605 -14.2575
13 C8x C 19.7512 -16.3780
14 C8x C 25.8791 -14.2516
15 C8x C 27.0942 -16.3957
16 C8x C 19.8214 -19.1820
17 C8x C 21.0481 -21.2615
18 C8x C 19.7570 -14.9643
19 C8x C 27.1117 -14.9585
20 C8x C 19.8271 -20.5781
21 C3b C 24.6744 -19.1589
22 N3a N 25.8300 -19.8800
BOND 24
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 2
7 4 8 1
8 4 9 2
9 5 10 2
10 5 11 1
11 6 12 2
12 7 13 1
13 8 14 2
14 9 15 1
15 10 16 1
16 11 17 2
17 12 18 1
18 14 19 1
19 16 20 2
20 13 18 2
21 15 19 2
22 17 20 1
23 2 21 1
24 21 22 3
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