Geometry & MOs

Info

ID:	12504
PubChem CID:	138979
Reduced:	OC5H6 (1)
Stoich.:	AB5C6 (1)
Weight, g/mol:	82.041865
ΔH_f, kcal/mol:	3.14
Dipole, Da:	4.4
IP(EA), eV:	-10.36(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pent-3-yn-2-one

Drug info:

PubChemData

Smile

CC#CC(=O)C

DOS

IR

Vibrations