Geometry & MOs

Info

ID:	158713
PubChem CID:	56465175
Reduced:	O4N5C21H25 (1)
Stoich.:	A4B5C21D25 (1)
Weight, g/mol:	417.147075
ΔH_f, kcal/mol:	-85.36
Dipole, Da:	1.26
IP(EA), eV:	-9.49(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]acetamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC=CC=C2N(C1=O)CC(=O)NC(C3=NC(=NO3)C4CC4)C(C)C

DOS

IR

Vibrations