Geometry & MOs

Info

ID:	262294
PubChem CID:	103282706
Reduced:	NO2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	240.136159
ΔH_f, kcal/mol:	-156.02
Dipole, Da:	2.97
IP(EA), eV:	-9.8(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-(2-methylpentoxymethyl)furan-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)O)C(=O)CNO

DOS

IR

Vibrations