Geometry & MOs

Info

ID:	23763
PubChem CID:	605985
Reduced:	O3C11H12 (1)
Stoich.:	A3B11C12 (1)
Weight, g/mol:	192.078644
ΔH_f, kcal/mol:	-57.47
Dipole, Da:	7.69
IP(EA), eV:	-9.68(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hex-1-ynylfuran-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCC#CC1=CC=C(O1)C(=O)O

DOS

IR

Vibrations