Geometry & MOs

Info

ID:	282243
PubChem CID:	103920050
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	271.097521
ΔH_f, kcal/mol:	-98.12
Dipole, Da:	4.24
IP(EA), eV:	-9.49(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenoxy)-N-[(2R)-1-hydroxybutan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(=O)C1=CC(=CC(=C1)C)C

DOS

IR

Vibrations