Geometry & MOs

Info

ID:	358299
PubChem CID:	127295844
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	392.217203
ΔH_f, kcal/mol:	-58.05
Dipole, Da:	7.44
IP(EA), eV:	-8.96(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CCNC(=O)N2CCC(C2)N3CCCCC3

DOS

IR

Vibrations