Geometry & MOs

Info

ID:	145315
PubChem CID:	53497213
Reduced:	OH16C18 (1)
Stoich.:	AB16C18 (1)
Weight, g/mol:	547.203822
ΔH_f, kcal/mol:	13.99
Dipole, Da:	1.6
IP(EA), eV:	-8.26(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[3-methoxy-4-(4-methoxy-2-methoxycarbonylphenyl)phenyl]methyl-triphenylphosphanium

Drug info:

PubChemData

Smile

CC1=CC(=CC2=C1C=C(C=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations