Geometry & MOs

Info

ID:	231791
PubChem CID:	87574670
Reduced:	PtO4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	501.23108
ΔH_f, kcal/mol:	-42.83
Dipole, Da:	2.15
IP(EA), eV:	-10.08(-3.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[4-[4-[6-amino-5-(1,3-benzothiazol-2-yl)pyridin-3-yl]pyrazol-1-yl]piperidin-1-yl]piperidin-1-yl]acetaldehyde

Drug info:

PubChemData

Smile

C/C(=C\C(=O)C)/[O-].C/C(=C\C(=O)C)/[O-].[Pt+2]

DOS

IR

Vibrations