Geometry & MOs

Info

ID:	293665
PubChem CID:	117395559
Reduced:	BrO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	256.00989
ΔH_f, kcal/mol:	-67.91
Dipole, Da:	0.54
IP(EA), eV:	-9.59(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-bromo-3-methoxyphenyl)methyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

CC(=O)CC1=C(C=CC=C1Br)COC

DOS

IR

Vibrations