Geometry & MOs

Info

ID:	303592
PubChem CID:	124489940
Reduced:	SN4O4C16H28 (1)
Stoich.:	AB4C4D16E28 (1)
Weight, g/mol:	372.183127
ΔH_f, kcal/mol:	-203.43
Dipole, Da:	5.78
IP(EA), eV:	-9.18(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-6-[5-[(3aS,4S,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-2-aminohexanoic acid

Drug info:

PubChemData

Smile

C1[C@@H]2[C@H]([C@@H](S1)CCCCC(=O)NCCCC[C@H](C(=O)O)N)NC(=O)N2

DOS

IR

Vibrations