Geometry & MOs

Info

ID:	242308
PubChem CID:	96099840
Reduced:	N5C12H19 (1)
Stoich.:	A5B12C19 (1)
Weight, g/mol:	303.169525
ΔH_f, kcal/mol:	44.88
Dipole, Da:	3.79
IP(EA), eV:	-9.07(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrazol-4-yl)-1-[(2S)-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C[C@@H](CCN)N1C(=NC2=C1N=CC=C2)CNC

DOS

IR

Vibrations