Geometry & MOs

Info

ID:	197794
PubChem CID:	78996973
Reduced:	NOC19H21 (1)
Stoich.:	ABC19D21 (1)
Weight, g/mol:	242.13068
ΔH_f, kcal/mol:	8.37
Dipole, Da:	2.16
IP(EA), eV:	-8.8(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2,6-dimethylphenyl)methoxy]phenyl]methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(C)NCC2=COC3=CC=CC=C32

DOS

IR

Vibrations