Geometry & MOs

Info

ID:	289675
PubChem CID:	104365571
Reduced:	BrNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	364.02296
ΔH_f, kcal/mol:	-43.57
Dipole, Da:	3.97
IP(EA), eV:	-8.73(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-7-[3-chloro-2-(3-methylphenyl)propyl]-2,3-dihydro-1-benzofuran

Drug info:

PubChemData

Smile

CCCC(C)(CC1=CC(=CC2=C1OCC2)Br)N

DOS

IR

Vibrations