Geometry & MOs

Info

ID:

180671

PubChem CID:

76667489

Reduced:

NPF9H29C30 (1)

Stoich.:

ABC9D29E30 (1)

Weight, g/mol:

498.9611

ΔHf, kcal/mol:

-441.72

Dipole, Da:

5.08

IP(EA), eV:

-8.84(-1.16)

Spin(Sz, S2):

None, None

Charge, e:

1

Chem-info

IUPAC name:

carbanide;chloropalladium(1+);diphenyl-(2-phosphonophenyl)phosphanium

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)P(C2CCCC2C(C3=CC=CC=C3)N(C)C)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations