Geometry & MOs

Info

ID:	89646
PubChem CID:	49963262
Reduced:	NSO2H15C19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	320.087101
ΔH_f, kcal/mol:	5.51
Dipole, Da:	3.82
IP(EA), eV:	-8.64(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)C(C3=NC4=CC=CC=C4S3)O

DOS

IR

Vibrations