Geometry & MOs

Info

ID:	383858
PubChem CID:	134975867
Reduced:	OC14H16 (1)
Stoich.:	AB14C16 (1)
Weight, g/mol:	162.104465
ΔH_f, kcal/mol:	-10.37
Dipole, Da:	1.02
IP(EA), eV:	-8.93(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclohexen-1-yl)pent-3-yn-2-one

Drug info:

PubChemData

Smile

CC1=C(OC=C1)CCCC2=CC=CC=C2

DOS

IR

Vibrations