Geometry & MOs

Info

ID:	202606
PubChem CID:	79698506
Reduced:	ClO2F3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	292.086622
ΔH_f, kcal/mol:	-254.26
Dipole, Da:	2.37
IP(EA), eV:	-9.12(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-3-methoxyphenyl)-[3-(methoxymethyl)phenyl]methanol

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2(CCC(CC2)C(F)(F)F)O)Cl

DOS

IR

Vibrations