Geometry & MOs

Info

ID:	27023
PubChem CID:	812617
Reduced:	O2N3C19H25 (1)
Stoich.:	A2B3C19D25 (1)
Weight, g/mol:	325.179027
ΔH_f, kcal/mol:	-29.64
Dipole, Da:	5.11
IP(EA), eV:	-9.55(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[(2S)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)(C)CC(=O)N1CCCC[C@@H]1C2=NC(=NO2)C3=CC=CC=C3

DOS

IR

Vibrations