Geometry & MOs

Info

ID:	340304
PubChem CID:	127262315
Reduced:	O2C11H18 (1)
Stoich.:	A2B11C18 (1)
Weight, g/mol:	180.11503
ΔH_f, kcal/mol:	-98.21
Dipole, Da:	0.65
IP(EA), eV:	-9.3(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hex-4-ynyl cyclobutanecarboxylate

Drug info:

PubChemData

Smile

CC(=CCCOC(=O)C1CCC1)C

DOS

IR

Vibrations