Geometry & MOs

Info

ID:	291419
PubChem CID:	112378987
Reduced:	NO2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	311.188529
ΔH_f, kcal/mol:	-107.07
Dipole, Da:	3.54
IP(EA), eV:	-9.32(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylphenyl)-N-(3-hydroxy-4-phenylbutan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC=C1)O)NC(=O)C2CCCCCC2

DOS

IR

Vibrations