Geometry & MOs

Info

ID:

46899

PubChem CID:

10528254

Reduced:

SN3O6C22H33 (1)

Stoich.:

AB3C6D22E33 (1)

Weight, g/mol:

467.175993

ΔHf, kcal/mol:

-287.72

Dipole, Da:

1.73

IP(EA), eV:

 -9.01(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl (2S,4S)-4-acetylsulfanyl-2-[[(2-methylpropan-2-yl)oxycarbonyl-(methylsulfamoyl)amino]methyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N2CCC[C@]23CC[C@@H]4N(C3=O)[C@H](CS4)C(=O)OC

DOS

IR

Vibrations