Geometry & MOs

Info

ID:	395659
PubChem CID:	135026156
Reduced:	IN2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	346.102751
ΔH_f, kcal/mol:	58.97
Dipole, Da:	5.3
IP(EA), eV:	-8.5(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4-methoxyphenyl)phenyl]-2-methylsulfanyl-1-benzofuran

Drug info:

PubChemData

Smile

CN(C)CC1=CC(=CN1)C2=CC=C(C=C2)I

DOS

IR

Vibrations