Geometry & MOs

Info

ID:	270478
PubChem CID:	103636748
Reduced:	ON2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	235.106925
ΔH_f, kcal/mol:	11.34
Dipole, Da:	4.63
IP(EA), eV:	-8.78(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)C2=CC3=C(C=C2)C=CN3

DOS

IR

Vibrations