Geometry & MOs

Info

ID:	46746
PubChem CID:	10526896
Reduced:	NSiO3C25H45 (1)
Stoich.:	ABC3D25E45 (1)
Weight, g/mol:	436.17467
ΔH_f, kcal/mol:	-215.17
Dipole, Da:	3.64
IP(EA), eV:	-9.57(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (4S)-5-amino-5-oxo-4-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]pentanoate

Drug info:

PubChemData

Smile

CCCCCC[C@H]1CC(=O)[C@@H]2CCCC[C@@]2(N1C(=O)OCC[Si](C)(C)C)CCC=C

DOS

IR

Vibrations