Geometry & MOs

Info

ID:	273226
PubChem CID:	103770719
Reduced:	SN2O4C11H16 (1)
Stoich.:	AB2C4D11E16 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-88.57
Dipole, Da:	2.89
IP(EA), eV:	-10.22(-2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2-phenoxybutanamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC=C(S1)[N+](=O)[O-])O

DOS

IR

Vibrations