Geometry & MOs

Info

ID:	311466
PubChem CID:	126592929
Reduced:	SO3N4C9H18 (1)
Stoich.:	AB3C4D9E18 (1)
Weight, g/mol:	228.099774
ΔH_f, kcal/mol:	-127.59
Dipole, Da:	1.28
IP(EA), eV:	-9.18(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-formyl-6,10-dioxodecanoic acid

Drug info:

PubChemData

Smile

C(CNC(=O)C(CC=O)SC[C@H](C(=O)N)N)N

DOS

IR

Vibrations