Geometry & MOs

Info

ID:

83053

PubChem CID:

49857070

Reduced:

NO9C23H33 (1)

Stoich.:

AB9C23D33 (1)

Weight, g/mol:

471.283857

ΔHf, kcal/mol:

-352.36

Dipole, Da:

3.03

IP(EA), eV:

 -9.69(-0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl (2S,3S)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-[(2R)-1-ethylsulfanyl-1-oxopent-4-en-2-yl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)O[C@H]1[C@H]2[C@@H](CO[C@H](O2)C3=CC=CC=C3)O[C@]([C@H]1O)(CC(=O)N(C)OC)OC

DOS

IR

Vibrations