Geometry & MOs

Info

ID:	395749
PubChem CID:	135026452
Reduced:	NOH19C25 (1)
Stoich.:	ABC19D25 (1)
Weight, g/mol:	518.08651
ΔH_f, kcal/mol:	113.78
Dipole, Da:	4.02
IP(EA), eV:	-8.89(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	-3

Chem-info

IUPAC name:

carbanide;2-(12-oxatetracyclo[6.3.1.02,7.09,11]dodeca-2,4,6-trien-10-ylidene)-N-phenyl-1-phenylethanimine;palladium;phosphane

Drug info:

PubChemData

Smile

C1C(C2C3=CC=CC=C3C1O2)C#CC(=NC4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations