Geometry & MOs

Info

ID:	385100
PubChem CID:	134978313
Reduced:	P2F6C23H24 (1)
Stoich.:	A2B6C23D24 (1)
Weight, g/mol:	526.141394
ΔH_f, kcal/mol:	-222.64
Dipole, Da:	16.67
IP(EA), eV:	-6.49(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-2,2-diphenyl-1,3,4,5-tetrahydrobenzo[i][2]benzophosphepin-2-ium;hexafluorophosphate

Drug info:

PubChemData

Smile

CC1=CC2=C(CCC[P+](C2)(C3=CC=CC=C3)C4=CC=CC=C4)C=C1.F[P-](F)(F)(F)(F)F

DOS

IR

Vibrations