Geometry & MOs

Info

ID:	399599
PubChem CID:	135041201
Reduced:	O2C6H9 (2)
Stoich.:	A2B6C9 (2)
Weight, g/mol:	339.02393
ΔH_f, kcal/mol:	-188.3
Dipole, Da:	5.64
IP(EA), eV:	-10.11(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-diphenylpent-4-ynylideneazanide;palladium(1+) monohydride

Drug info:

PubChemData

Smile

CC(=O)CC1CCC2(CCC1=O)OCCO2

DOS

IR

Vibrations