O=[N+]([O-])c1cc(Cl)c(Cl)nc1Cl
SMILES: O=[N+]([O-])c1cc(Cl)c(Cl)nc1Cl

Molecular Processing

Molecular formula
C5HCl3N2O2
Molecular weight
227.43
Exact mass
225.9104
XLogP
2.95
TPSA
56.03
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
45.92

Supplementary Information

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