Geometry & MOs

Info

ID:	337966
PubChem CID:	127258589
Reduced:	O5C15H24 (1)
Stoich.:	A5B15C24 (1)
Weight, g/mol:	236.116092
ΔH_f, kcal/mol:	-256.32
Dipole, Da:	7.96
IP(EA), eV:	-10.55(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-2-[(E)-[methyl(phenyl)hydrazinylidene]methyl]butanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)C1(CCCCC1)C(=O)CCCC(=O)O

DOS

IR

Vibrations