Geometry & MOs

Info

ID:	180632
PubChem CID:	76662382
Reduced:	FN3O4C24H32 (1)
Stoich.:	AB3C4D24E32 (1)
Weight, g/mol:	587.10497
ΔH_f, kcal/mol:	-196.72
Dipole, Da:	3.83
IP(EA), eV:	-9.32(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

palladium(2+);2-(5-phenyl-3H-pyrazol-3-id-2-yl)-4-[2-[6-(5-phenyl-3H-pyrazol-3-id-2-yl)pyridin-2-yl]propan-2-yl]pyrimidine

Drug info:

PubChemData

Smile

CCOC(=O)C1C2C1C(C(C2)O)CC3=CC(=C(C=C3)F)C4(C(C(=O)N(C(=N4)N)C)(C)C)C

DOS

IR

Vibrations