Geometry & MOs

Info

ID:	70646
PubChem CID:	48413653
Reduced:	O3N5H21C22 (1)
Stoich.:	A3B5C21D22 (1)
Weight, g/mol:	415.129884
ΔH_f, kcal/mol:	-2.93
Dipole, Da:	3.28
IP(EA), eV:	-9.43(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4,5-dimethoxy-N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

DOS

IR

Vibrations