Geometry & MOs

Info

ID:	291450
PubChem CID:	112379018
Reduced:	NOC9H11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	277.167794
ΔH_f, kcal/mol:	-63.08
Dipole, Da:	4.79
IP(EA), eV:	-9.34(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-4-phenylbutan-2-yl)oxane-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)CC(=O)NC(C)C(CC2=CC=CC=C2)O

DOS

IR

Vibrations