Geometry & MOs

Info

ID:	340299
PubChem CID:	127262310
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	180.11503
ΔH_f, kcal/mol:	-70.37
Dipole, Da:	1.85
IP(EA), eV:	-10.02(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-3-ynyl cyclobutanecarboxylate

Drug info:

PubChemData

Smile

CCCC#CCCOC(=O)C1CCC1

DOS

IR

Vibrations