Geometry & MOs

Info

ID:	394013
PubChem CID:	135022169
Reduced:	ClNO2H8C11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	302.09185
ΔH_f, kcal/mol:	-37.63
Dipole, Da:	6.63
IP(EA), eV:	-9.68(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-naphthalen-1-yl-[3-(trifluoromethyl)phenyl]methanol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=O)O1)C2=NC(=CC=C2)Cl

DOS

IR

Vibrations