Geometry & MOs

Info

ID:	291432
PubChem CID:	112379000
Reduced:	NO2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	300.147393
ΔH_f, kcal/mol:	-66.29
Dipole, Da:	5.43
IP(EA), eV:	-9.35(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-4-phenylbutan-2-yl)-1-methyl-2-oxopyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NC(C)C(CC2=CC=CC=C2)O)[N+](=O)[O-]

DOS

IR

Vibrations