Geometry & MOs

Info

ID:	89681
PubChem CID:	49963658
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	298.102751
ΔH_f, kcal/mol:	-42.19
Dipole, Da:	1.91
IP(EA), eV:	-8.58(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethylthiophen-2-yl)-(2-methoxynaphthalen-1-yl)methanol

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(O1)C(C2=CNC3=CC=CC=C32)O

DOS

IR

Vibrations