Geometry & MOs

Info

ID:	11671
PubChem CID:	118786
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-122.02
Dipole, Da:	3.06
IP(EA), eV:	-10.43(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylnon-2-enoic acid

Drug info:

PubChemData

Smile

CCCCCCC(=CC(=O)O)C

DOS

IR

Vibrations