Geometry & MOs

Info

ID:	357601
PubChem CID:	127294274
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	377.279075
ΔH_f, kcal/mol:	-8.81
Dipole, Da:	2.4
IP(EA), eV:	-8.66(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-1-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=C2)C(=O)N3CCN(CC3)CC4CCCCN4C

DOS

IR

Vibrations