Geometry & MOs

Info

ID:	330325
PubChem CID:	127247312
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-11.63
Dipole, Da:	3.98
IP(EA), eV:	-9.22(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-5-methyl-1,2-oxazol-4-yl)-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCCC1=CC(=NO1)C(=O)N2CCCCC2C3=C(C=NN3)C

DOS

IR

Vibrations