Geometry & MOs

Info

ID:	56277
PubChem CID:	17422950
Reduced:	N3O3H17C19 (1)
Stoich.:	A3B3C17D19 (1)
Weight, g/mol:	370.089975
ΔH_f, kcal/mol:	16.71
Dipole, Da:	6.36
IP(EA), eV:	-9.72(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-[(3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=C2C=C(C=CC2=N1)[N+](=O)[O-])C3=CC=CC=C3)C(=O)N(C)C

DOS

IR

Vibrations