Geometry & MOs

Info

ID:	380698
PubChem CID:	134971225
Reduced:	FO2C8H8 (2)
Stoich.:	AB2C8D8 (2)
Weight, g/mol:	310.101665
ΔH_f, kcal/mol:	-238.88
Dipole, Da:	3.48
IP(EA), eV:	-9.68(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(4S,5R)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-yl]-3,3-difluoro-2H-pyran-6-one

Drug info:

PubChemData

Smile

CC1(O[C@@H]([C@H](O1)C2=CC=CC=C2)[C@H]3C(C=CC(=O)O3)(F)F)C

DOS

IR

Vibrations