Geometry & MOs

Info

ID:	192899
PubChem CID:	78323005
Reduced:	SN2O2H16C17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	586.211901
ΔH_f, kcal/mol:	-20.74
Dipole, Da:	1.14
IP(EA), eV:	-8.71(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexane-1,2-diamine;2-cyclopenta-2,4-dien-1-yl-2-(3-pyrrolidin-1-ylpropyl)propanedioate;platinum(2+)

Drug info:

PubChemData

Smile

C1COCCC1N2C=NC3=C(C2=O)SC=C3C4=CC=CC=C4

DOS

IR

Vibrations