Geometry & MOs

Info

ID:	227513
PubChem CID:	87561896
Reduced:	O9C10H16 (1)
Stoich.:	A9B10C16 (1)
Weight, g/mol:	417.134301
ΔH_f, kcal/mol:	-384.64
Dipole, Da:	5.02
IP(EA), eV:	-10.72(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(=O)C(=O)O[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)C(=O)O

DOS

IR

Vibrations