Geometry & MOs

Info

ID:	289672
PubChem CID:	104365315
Reduced:	BrO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	310.023057
ΔH_f, kcal/mol:	-97.08
Dipole, Da:	2.77
IP(EA), eV:	-8.74(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-7-[(4-fluorophenyl)sulfinylmethyl]-2,3-dihydro-1-benzofuran

Drug info:

PubChemData

Smile

CC(C)C(CCCC1=CC(=CC2=C1OCC2)Br)O

DOS

IR

Vibrations