Geometry & MOs

Info

ID:	224590
PubChem CID:	85345153
Reduced:	OC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	268.113316
ΔH_f, kcal/mol:	-71.07
Dipole, Da:	4.79
IP(EA), eV:	-9.44(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(methoxymethoxy)-4-phenylsulfanylbutyl]oxirane

Drug info:

PubChemData

Smile

C1CC2C3CC(=O)C(C3C(C1)C2=O)CC4=CC=CC=C4

DOS

IR

Vibrations