이름: 9-chloro-5H-dibenz[b,e]azepin-6,11-dione
SMILES:
O=c1[nH]c2ccccc2c(=O)c2cc(Cl)ccc12Molecular Processing
Molecular formula
C14H8ClNO2
Molecular weight
257.68
Exact mass
257.0244
XLogP
2.69
TPSA
49.93
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
73.35
Supplementary Information
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