Geometry & MOs

Info

ID:	275918
PubChem CID:	103819099
Reduced:	BrNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	-138.8
Dipole, Da:	1.03
IP(EA), eV:	-9.35(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylamino)-N-(2-hydroxy-4-methylpentyl)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations