Geometry & MOs

Info

ID:	330339
PubChem CID:	127247326
Reduced:	ON5C17H25 (1)
Stoich.:	AB5C17D25 (1)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	2.85
Dipole, Da:	7.95
IP(EA), eV:	-9.03(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)CCC3=C(N(N=C3)C)C

DOS

IR

Vibrations