Geometry & MOs

Info

ID:	318097
PubChem CID:	126648942
Reduced:	N3O4C20H21 (1)
Stoich.:	A3B4C20D21 (1)
Weight, g/mol:	352.02227
ΔH_f, kcal/mol:	-109.83
Dipole, Da:	2.57
IP(EA), eV:	-9.63(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[(2-fluoro-3-methylphenyl)methyl]-N-methyl-2-oxo-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC(=C1)CN2C=C(C=C(C2=O)C(=O)NC)C(=O)NC3CC3

DOS

IR

Vibrations