Geometry & MOs

Info

ID:	397889
PubChem CID:	135030914
Reduced:	OC12H14 (2)
Stoich.:	AB12C14 (2)
Weight, g/mol:	318.02554
ΔH_f, kcal/mol:	-16.63
Dipole, Da:	2.84
IP(EA), eV:	-9.31(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-7-methoxy-2-(4-methylphenyl)-2,3-dihydro-1-benzofuran

Drug info:

PubChemData

Smile

C1CCC(CC1)CC#CC(OCC2=CC=CC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations