Geometry & MOs

Info

ID:	263178
PubChem CID:	103343593
Reduced:	O2C7H8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	-149.59
Dipole, Da:	2.11
IP(EA), eV:	-9.12(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-3-pent-3-ynyloxolan-2-one

Drug info:

PubChemData

Smile

CC(=O)C1(CCOC1=O)CC2=CC(=CC=C2)OC

DOS

IR

Vibrations