Geometry & MOs

Info

ID:	388004
PubChem CID:	134987800
Reduced:	BrO2C9H11 (1)
Stoich.:	AB2C9D11 (1)
Weight, g/mol:	194.13068
ΔH_f, kcal/mol:	-31.51
Dipole, Da:	1.98
IP(EA), eV:	-9.95(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclopentylethynoxy)oxane

Drug info:

PubChemData

Smile

CC(=O)OC(C)(CC#CBr)C=C

DOS

IR

Vibrations