Geometry & MOs

Info

ID:	407559
PubChem CID:	135080306
Reduced:	PO4C6H15 (1)
Stoich.:	AB4C6D15 (1)
Weight, g/mol:	334.03051
ΔH_f, kcal/mol:	-254.77
Dipole, Da:	4.27
IP(EA), eV:	-10.35(1.25)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(3aR,8aR)-7-(hydroxymethyl)-3a-methyl-1,2,3,5,6,8a-hexahydroazulen-1-id-4-one;praseodymium

Drug info:

PubChemData

Smile

CC[C@H](CP(=O)(OC)OC)O

DOS

IR

Vibrations