Geometry & MOs

Info

ID:

412597

PubChem CID:

135085494

Reduced:

PdCl2P2C27H49 (1)

Stoich.:

AB2C2D27E49 (1)

Weight, g/mol:

658.31255

ΔHf, kcal/mol:

37.89

Dipole, Da:

8.0

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754159

Charge, e:

 1

Chem-info

IUPAC name:

carbanide;chloropalladium(1+);ditert-butyl-[[2,8,9-tris(2-methylpropyl)-2,5,8,9-tetraza-1lambda5-phosphabicyclo[3.3.3]undecan-1-ylidene]amino]phosphanium

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C[C-]1[PH+](C2CCCCC2)C3CCCCC3)[PH+](C(C)(C)C)C(C)(C)C.Cl[Pd]Cl

DOS

IR

Vibrations