Geometry & MOs

Info

ID:	354859
PubChem CID:	127287619
Reduced:	SN4O4C17H28 (1)
Stoich.:	AB4C4D17E28 (1)
Weight, g/mol:	281.148789
ΔH_f, kcal/mol:	-137.89
Dipole, Da:	8.06
IP(EA), eV:	-9.52(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-ylamino]acetyl]piperazin-2-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NCC(=O)N(C2CCCC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations