Geometry & MOs

Info

ID:	349739
PubChem CID:	127275901
Reduced:	O2N3C23H25 (1)
Stoich.:	A2B3C23D25 (1)
Weight, g/mol:	379.200825
ΔH_f, kcal/mol:	-2.95
Dipole, Da:	3.08
IP(EA), eV:	-8.69(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-methylphenyl)-1H-pyrazol-5-yl]-[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)C2CCCN(C2)C(=O)C3=CC=C4CCC5=C4C3=CC=C5

DOS

IR

Vibrations