Geometry & MOs

Info

ID:	224884
PubChem CID:	85575077
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	617.378381
ΔH_f, kcal/mol:	-97.87
Dipole, Da:	1.9
IP(EA), eV:	-9.1(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diundecyl 2-[(2-ethoxycarbothioylsulfanylacetyl)amino]pentanedioate

Drug info:

PubChemData

Smile

CCCCC=CC=CCC(=O)OCC

DOS

IR

Vibrations