Geometry & MOs

Info

ID:	419158
PubChem CID:	135107628
Reduced:	N2O4C19H22 (1)
Stoich.:	A2B4C19D22 (1)
Weight, g/mol:	350.114568
ΔH_f, kcal/mol:	-104.63
Dipole, Da:	4.04
IP(EA), eV:	-9.49(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloropyridin-2-yl)-2-[(3S,4R)-3-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CO[C@H](C1=CC=CC=C1)C(=O)N2CCCN(CC2)C(=O)C3=COC=C3

DOS

IR

Vibrations