Geometry & MOs

Info

ID:	282244
PubChem CID:	103920103
Reduced:	ClNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-134.21
Dipole, Da:	2.63
IP(EA), eV:	-9.22(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-hydroxybutan-2-yl]-4-(2-methylphenoxy)butanamide

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(=O)C(C)OC1=CC=C(C=C1)Cl

DOS

IR

Vibrations