Geometry & MOs

Info

ID:	89662
PubChem CID:	49963394
Reduced:	NOH9C10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	358.118064
ΔH_f, kcal/mol:	4.3
Dipole, Da:	4.91
IP(EA), eV:	-8.65(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-phenylmethoxyphenyl)-[2-(trifluoromethyl)phenyl]methanol

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1C(C3=CC=C(C4=CC=CC=C43)OC)O

DOS

IR

Vibrations