Geometry & MOs

Info

ID:	341575
PubChem CID:	127264268
Reduced:	PtN2O7C12H21 (1)
Stoich.:	AB2C7D12E21 (1)
Weight, g/mol:	194.042653
ΔH_f, kcal/mol:	-162.16
Dipole, Da:	5.83
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.712476
Charge, e:	0

Chem-info

IUPAC name:

(1,2,3,4-tetrahydroxy-5-oxopentyl) formate

Drug info:

PubChemData

Smile

C1CCC(C(C1)[NH-])[NH-].C(=O)C(C(C(C(O)O[C-]=O)O)O)O.[Pt]

DOS

IR

Vibrations