Geometry & MOs

Info

ID:	234704
PubChem CID:	92303347
Reduced:	SN3O3C16H29 (1)
Stoich.:	AB3C3D16E29 (1)
Weight, g/mol:	406.156554
ΔH_f, kcal/mol:	-160.25
Dipole, Da:	5.29
IP(EA), eV:	-9.25(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

6-[5-[(3aR,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexoxy-hydroxy-oxophosphanium

Drug info:

PubChemData

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

DOS

IR

Vibrations