Geometry & MOs

Info

ID:	346115
PubChem CID:	127270603
Reduced:	O2N7C17H21 (1)
Stoich.:	A2B7C17D21 (1)
Weight, g/mol:	336.190989
ΔH_f, kcal/mol:	32.54
Dipole, Da:	6.29
IP(EA), eV:	-9.3(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclopropylamino)-2-oxoethyl]-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)N2CCC(CC2)C3=NN=C4N3C=CC=C4

DOS

IR

Vibrations