Geometry & MOs

Info

ID:	70665
PubChem CID:	48413684
Reduced:	N2O2C9H12 (2)
Stoich.:	A2B2C9D12 (2)
Weight, g/mol:	403.200825
ΔH_f, kcal/mol:	-111.5
Dipole, Da:	2.96
IP(EA), eV:	-9.63(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-benzimidazol-2-yl)-N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]butanamide

Drug info:

PubChemData

Smile

CCOC(=O)NCCC(=O)NC(C1=NC(=NO1)C2=CC=CC=C2)C(C)C

DOS

IR

Vibrations