Geometry & MOs

Info

ID:	362446
PubChem CID:	127307792
Reduced:	O3N7C18H23 (1)
Stoich.:	A3B7C18D23 (1)
Weight, g/mol:	363.22704
ΔH_f, kcal/mol:	-5.23
Dipole, Da:	4.75
IP(EA), eV:	-8.82(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazin-1-yl]-2-oxoethyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C(C)N2CCN(CC2)C(=O)CCN3C(=O)N4C=CC=CC4=N3

DOS

IR

Vibrations