Geometry & MOs

Info

ID:	348025
PubChem CID:	127273087
Reduced:	ON6C15H24 (1)
Stoich.:	AB6C15D24 (1)
Weight, g/mol:	334.236876
ΔH_f, kcal/mol:	29.5
Dipole, Da:	4.77
IP(EA), eV:	-9.28(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethylpiperidin-1-yl)-2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCN1C=NN=C1C2CCCN(C2)CC3=NN=C(O3)C(C)C

DOS

IR

Vibrations