Geometry & MOs

Info

ID:	273638
PubChem CID:	103771530
Reduced:	BrNSO2C11H16 (1)
Stoich.:	ABCD2E11F16 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-76.08
Dipole, Da:	1.74
IP(EA), eV:	-9.77(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC=C(S1)Br)O

DOS

IR

Vibrations