Geometry & MOs

Info

ID:	294523
PubChem CID:	117466862
Reduced:	BrO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	288.03611
ΔH_f, kcal/mol:	-148.56
Dipole, Da:	3.42
IP(EA), eV:	-8.67(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-2,4-dimethoxy-5-methylphenyl)propan-1-ol

Drug info:

PubChemData

Smile

CC(CO)C1=CC2=C(C(=C1O)Br)OCCO2

DOS

IR

Vibrations