Geometry & MOs

Info

ID:	30141
PubChem CID:	840282
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	283.157229
ΔH_f, kcal/mol:	-61.47
Dipole, Da:	2.76
IP(EA), eV:	-8.48(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3,4-dimethylphenyl)-2-phenoxybutanamide

Drug info:

PubChemData

Smile

CC[C@H](C(=O)NC1=C(C=C(C=C1)C)C)OC2=CC=CC=C2

DOS

IR

Vibrations