Geometry & MOs

Info

ID:	279645
PubChem CID:	103844561
Reduced:	NSO2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	278.13068
ΔH_f, kcal/mol:	-31.17
Dipole, Da:	1.23
IP(EA), eV:	-9.06(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(naphthalen-1-ylmethoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)OCC2=NC=CS2

DOS

IR

Vibrations