Geometry & MOs

Info

ID:	330250
PubChem CID:	127247237
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	29.6
Dipole, Da:	7.23
IP(EA), eV:	-9.61(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CC=NN2)C(=O)CN3C=CN=C3

DOS

IR

Vibrations