Geometry & MOs

Info

ID:	200632
PubChem CID:	79418299
Reduced:	FO3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	296.07758
ΔH_f, kcal/mol:	-169.07
Dipole, Da:	3.08
IP(EA), eV:	-9.83(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-bromo-3-(2-methylphenyl)butyl]oxolane

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(CCO)C(=O)O)F

DOS

IR

Vibrations