Geometry & MOs

Info

ID:	365988
PubChem CID:	127319278
Reduced:	O2N5C13H17 (1)
Stoich.:	A2B5C13D17 (1)
Weight, g/mol:	330.180424
ΔH_f, kcal/mol:	16.98
Dipole, Da:	2.51
IP(EA), eV:	-9.75(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[3-(pyrazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

C1CCC(=O)N(CC1)CC2=NC(=NO2)CN3C=CC=N3

DOS

IR

Vibrations