Geometry & MOs

Info

ID:	155771
PubChem CID:	56367472
Reduced:	O3N4C21H24 (1)
Stoich.:	A3B4C21D24 (1)
Weight, g/mol:	439.05315
ΔH_f, kcal/mol:	-88.41
Dipole, Da:	5.45
IP(EA), eV:	-8.56(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-bromophenyl)-1-benzyl-2-oxopyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCC(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations