Geometry & MOs

Info

ID:	89668
PubChem CID:	49963444
Reduced:	ON2H16C20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	346.102751
ΔH_f, kcal/mol:	70.26
Dipole, Da:	2.07
IP(EA), eV:	-8.8(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzothiophen-2-yl-(4-phenylmethoxyphenyl)methanol

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)C(C3=CC=CC=C3N4C=CC=N4)O

DOS

IR

Vibrations