Geometry & MOs

Info

ID:	273758
PubChem CID:	103799552
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	361.05249
ΔH_f, kcal/mol:	-153.16
Dipole, Da:	5.29
IP(EA), eV:	-9.43(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(=O)NC(CCO)COC

DOS

IR

Vibrations