Geometry & MOs

Info

ID:	340741
PubChem CID:	127262752
Reduced:	NOPC40H44 (1)
Stoich.:	ABCD40E44 (1)
Weight, g/mol:	545.140136
ΔH_f, kcal/mol:	23.48
Dipole, Da:	0.84
IP(EA), eV:	-7.84(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl-[2-(N-(4-methylphenyl)anilino)phenyl]-phenylphosphanium;trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CN(C)C1=CC(=CC=C1)OC2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)P(C6CCCCC6)C7CCCCC7

DOS

IR

Vibrations