Geometry & MOs

Info

ID:	53266
PubChem CID:	14709933
Reduced:	NSi2O4C27H49 (1)
Stoich.:	AB2C4D27E49 (1)
Weight, g/mol:	471.320012
ΔH_f, kcal/mol:	-304.68
Dipole, Da:	4.64
IP(EA), eV:	-8.79(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2R,5R)-2,5-bis[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidin-1-yl]-2-hydroxy-2-methylpent-4-en-1-one

Drug info:

PubChemData

Smile

C[C@@](C1=CC=CC=C1)(C(=O)N2[C@H](CC[C@@H]2CO[Si](C)(C)C(C)(C)C)CO[Si](C)(C)C(C)(C)C)O

DOS

IR

Vibrations