Geometry & MOs

Info

ID:	394812
PubChem CID:	135023846
Reduced:	O6C17H24 (1)
Stoich.:	A6B17C24 (1)
Weight, g/mol:	322.141638
ΔH_f, kcal/mol:	-244.87
Dipole, Da:	3.54
IP(EA), eV:	-9.45(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(1R,2R)-1,2-bis(methoxymethoxy)-2-phenylethyl]-2,3-dihydropyran-6-one

Drug info:

PubChemData

Smile

COCO[C@H]([C@H]1CCCC(=O)O1)[C@@H](C2=CC=CC=C2)OCOC

DOS

IR

Vibrations