Geometry & MOs

Info

ID:	216125
PubChem CID:	85085762
Reduced:	OC16H22 (1)
Stoich.:	AB16C22 (1)
Weight, g/mol:	230.134051
ΔH_f, kcal/mol:	-25.63
Dipole, Da:	2.31
IP(EA), eV:	-9.39(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methyl-1-(thietan-2-yl)propoxy]oxane

Drug info:

PubChemData

Smile

C1CC2CC=C(C2C1)C3(CC4CCC3C=C4)O

DOS

IR

Vibrations