Geometry & MOs

Info

ID:	419718
PubChem CID:	135108862
Reduced:	N3O4C20H23 (1)
Stoich.:	A3B4C20D23 (1)
Weight, g/mol:	348.110151
ΔH_f, kcal/mol:	-93.17
Dipole, Da:	5.65
IP(EA), eV:	-9.47(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-(6-chloro-1H-benzimidazol-2-yl)ethyl-methylamino]methyl]-N-methyl-1,2,4-oxadiazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2CCN(CC2)C3=NOC(=C3C(=O)O)C4=CC=CC=C4

DOS

IR

Vibrations