Geometry & MOs

Info

ID:	174922
PubChem CID:	75832707
Reduced:	O2N3C22H35 (1)
Stoich.:	A2B3C22D35 (1)
Weight, g/mol:	415.270916
ΔH_f, kcal/mol:	-110.69
Dipole, Da:	2.93
IP(EA), eV:	-8.51(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-[2-(3,5-dimethylpiperidin-1-ium-1-yl)-2-methylpropyl]-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(C)(C)CNC(=O)CCNC(=O)CC2=CC=CC=C2)C

DOS

IR

Vibrations