Geometry & MOs

Info

ID:	277386
PubChem CID:	103828179
Reduced:	NO2C16H19 (1)
Stoich.:	AB2C16D19 (1)
Weight, g/mol:	315.00072
ΔH_f, kcal/mol:	-40.03
Dipole, Da:	5.08
IP(EA), eV:	-8.42(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(4-cyanophenyl)-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)C2C3C2C4CCC3C4)O

DOS

IR

Vibrations