Geometry & MOs

Info

ID:	46025
PubChem CID:	10520544
Reduced:	FNCl2O3H12C14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	332.092974
ΔH_f, kcal/mol:	-163.34
Dipole, Da:	8.18
IP(EA), eV:	-9.38(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[(1R)-3,3-dimethoxy-1-phenylmethoxypropyl]-1,3,2-dioxathiolane 2,2-dioxide

Drug info:

PubChemData

Smile

COC(=O)/C(=C/1\CCCN1)/C(=O)C2=CC(=C(C=C2Cl)Cl)F

DOS

IR

Vibrations