Geometry & MOs

Info

ID:	330376
PubChem CID:	127247363
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	339.169525
ΔH_f, kcal/mol:	4.44
Dipole, Da:	4.85
IP(EA), eV:	-8.19(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)C3=CC=C(C=C3)N4CCCC4

DOS

IR

Vibrations