Geometry & MOs

Info

ID:	392593
PubChem CID:	135017293
Reduced:	NO5C26H41 (1)
Stoich.:	AB5C26D41 (1)
Weight, g/mol:	461.299277
ΔH_f, kcal/mol:	-244.05
Dipole, Da:	2.37
IP(EA), eV:	-8.96(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R,4R)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methoxypyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1(OC[C@@H](O1)[C@H](C=O)[C@H]2[C@@H]([C@H](CN2CC3=CC=CC=C3)OC(C)(C)C)OC(C)(C)C)C

DOS

IR

Vibrations