Geometry & MOs

Info

ID:	52525
PubChem CID:	12015421
Reduced:	NSSiO4C27H39 (1)
Stoich.:	ABCD4E27F39 (1)
Weight, g/mol:	333.212406
ΔH_f, kcal/mol:	-183.72
Dipole, Da:	2.33
IP(EA), eV:	-8.81(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-3-[tert-butyl(dimethyl)silyl]oxypyrrolidin-1-yl]-3-phenylpropan-1-one

Drug info:

PubChemData

Smile

C[C@H]([C@H](C1=CC=CC=C1)O[Si](C)(C)C(C)(C)C)N(C)C(=O)C(CC=C)S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations