Geometry & MOs

Info

ID:	128531
PubChem CID:	51048976
Reduced:	Cl2N2O5H18C19 (1)
Stoich.:	A2B2C5D18E19 (1)
Weight, g/mol:	380.11207
ΔH_f, kcal/mol:	-155.36
Dipole, Da:	9.31
IP(EA), eV:	-9.2(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-N'-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]oxamide

Drug info:

PubChemData

Smile

C1CN(CCC1=O)CC2=CC(=O)C(=CO2)OCC(=O)NC3=CC(=CC(=C3)Cl)Cl

DOS

IR

Vibrations