Geometry & MOs

Info

ID:	268667
PubChem CID:	103600381
Reduced:	INO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	327.08339
ΔH_f, kcal/mol:	-35.36
Dipole, Da:	3.96
IP(EA), eV:	-9.11(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-hydroxy-N-(6-methylheptan-2-yl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN(C)C(=O)C2=C(C=CC(=C2)I)O

DOS

IR

Vibrations