Geometry & MOs

Info

ID:

382779

PubChem CID:

134974118

Reduced:

O5C14H24 (1)

Stoich.:

A5B14C24 (1)

Weight, g/mol:

465.181894

ΔHf, kcal/mol:

-261.6

Dipole, Da:

2.06

IP(EA), eV:

 -10.16(1.39)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-4-[[4-(3,5-dimethyl-2,6,7-trioxa-1-silabicyclo[2.2.1]heptan-1-yl)phenyl]methoxy]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1(OCC2(O1)CC[C@@H]3[C@H]([C@@H]2CO)OC(O3)(C)C)C

DOS

IR

Vibrations