Geometry & MOs

Info

ID:	273584
PubChem CID:	103771420
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-140.59
Dipole, Da:	2.0
IP(EA), eV:	-9.0(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyanophenoxy)-N-(2-hydroxy-4-methylpentyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC(=O)NCC(CC(C)C)O

DOS

IR

Vibrations