Geometry & MOs

Info

ID:	29225
PubChem CID:	832433
Reduced:	NO3C19H23 (1)
Stoich.:	AB3C19D23 (1)
Weight, g/mol:	347.128821
ΔH_f, kcal/mol:	-89.82
Dipole, Da:	4.43
IP(EA), eV:	-8.32(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]benzamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1[C@@H](C)NC(=O)C2=CC=CC=C2)OC)OC

DOS

IR

Vibrations