Geometry & MOs

Info

ID:	157527
PubChem CID:	56435540
Reduced:	O2N5C23H29 (1)
Stoich.:	A2B5C23D29 (1)
Weight, g/mol:	404.9741
ΔH_f, kcal/mol:	-10.48
Dipole, Da:	6.68
IP(EA), eV:	-9.1(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)NC(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations