Geometry & MOs

Info

ID:	89659
PubChem CID:	49963338
Reduced:	OCl2N2H12C15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	304.14633
ΔH_f, kcal/mol:	12.22
Dipole, Da:	2.72
IP(EA), eV:	-9.12(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylphenyl)-(2-phenylmethoxyphenyl)methanol

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1C(C3=C(C(=CC=C3)Cl)Cl)O

DOS

IR

Vibrations