Geometry & MOs

Info

ID:	273489
PubChem CID:	103771209
Reduced:	BrNO4C15H22 (1)
Stoich.:	ABC4D15E22 (1)
Weight, g/mol:	291.219829
ΔH_f, kcal/mol:	-164.4
Dipole, Da:	2.59
IP(EA), eV:	-9.25(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations