COMPOUND: C00604
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Entry
C00604 Compound
Name
1,10-Phenanthroline;
o-Phenanthroline
Formula
C12H8N2
Exact mass
180.0687
Mol weight
180.20
Structure
Mol file
KCF file
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Other DBs
CAS:
66-71-7
PubChem:
3879
ChEBI:
44975
PDB-CCD:
PHN
[
PDBj
]
NIKKAJI:
J4.844E
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KCF data
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ATOM 14
1 C8y C 26.8654 -18.9570
2 C8y C 28.0740 -18.2547
3 C8y C 26.8654 -20.3493
4 N5x N 25.6630 -18.2736
5 C8y C 29.3591 -18.9507
6 N5x N 28.0614 -16.8435
7 C8x C 28.0804 -21.0516
8 C8x C 25.6630 -21.0516
9 C8x C 24.4671 -18.9570
10 C8x C 29.3017 -20.3555
11 C8x C 30.5103 -18.2420
12 C8x C 29.2828 -16.1347
13 C8x C 24.4671 -20.3493
14 C8x C 30.5168 -16.8308
BOND 16
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 1
11 6 12 2
12 8 13 2
13 11 14 2
14 7 10 2
15 9 13 1
16 12 14 1
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