Geometry & MOs

Info

ID:	385101
PubChem CID:	134978315
Reduced:	P2F6H26C27 (1)
Stoich.:	A2B6C26D27 (1)
Weight, g/mol:	381.177213
ΔH_f, kcal/mol:	-409.68
Dipole, Da:	18.78
IP(EA), eV:	-9.27(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CC[P+](CC2=C1C=CC3=CC=CC=C23)(C4=CC=CC=C4)C5=CC=CC=C5.F[P-](F)(F)(F)(F)F

DOS

IR

Vibrations