Geometry & MOs

Info

ID:	44302
PubChem CID:	10502610
Reduced:	NSO4C24H29 (1)
Stoich.:	ABC4D24E29 (1)
Weight, g/mol:	427.230772
ΔH_f, kcal/mol:	-130.14
Dipole, Da:	7.09
IP(EA), eV:	-9.34(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,5R)-1-benzyl-5-(dimethoxyphosphorylmethyl)pyrrolidin-2-yl]methoxy-tert-butyl-dimethylsilane

Drug info:

PubChemData

Smile

C1C[C@@H]2C[C@H]1[C@H]([C@@H]2NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C/C=C\CCCC(=O)O

DOS

IR

Vibrations