Geometry & MOs

Info

ID:	231917
PubChem CID:	87574907
Reduced:	SO3C14H28 (1)
Stoich.:	AB3C14D28 (1)
Weight, g/mol:	390.193691
ΔH_f, kcal/mol:	-194.74
Dipole, Da:	7.0
IP(EA), eV:	-8.93(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid;2,6-diaminohexanoic acid

Drug info:

PubChemData

Smile

CC(=O)C.C(CCCCCS)CCCCC(=O)O

DOS

IR

Vibrations