Geometry & MOs

Info

ID:	144578
PubChem CID:	53386792
Reduced:	NSiO3C11H23 (1)
Stoich.:	ABC3D11E23 (1)
Weight, g/mol:	333.17602
ΔH_f, kcal/mol:	-205.5
Dipole, Da:	3.28
IP(EA), eV:	-8.88(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,6R,7aS)-6-[tert-butyl(dimethyl)silyl]oxy-3-phenyl-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-5-one

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O[C@@H]1C[C@H](NC1=O)CO

DOS

IR

Vibrations