Geometry & MOs

Info

ID:	385785
PubChem CID:	134979978
Reduced:	O4C6H11 (2)
Stoich.:	A4B6C11 (2)
Weight, g/mol:	350.085781
ΔH_f, kcal/mol:	-375.79
Dipole, Da:	3.14
IP(EA), eV:	-10.27(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3aR,5R,6S,6aS)-5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]sulfanyl-methylsulfanylmethanone

Drug info:

PubChemData

Smile

CC(C(C[C@H]1[C@@H]([C@H](C[C@@](O1)(C(=O)OC)OC)O)O)O)O

DOS

IR

Vibrations