Geometry & MOs

Info

ID:	142473
PubChem CID:	53039841
Reduced:	ON7C23H27 (1)
Stoich.:	AB7C23D27 (1)
Weight, g/mol:	353.093104
ΔH_f, kcal/mol:	68.11
Dipole, Da:	4.16
IP(EA), eV:	-8.82(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=C(N3C=CN=CC3=N2)NCCC(=O)N4CCN(CC4)CCC#N

DOS

IR

Vibrations