Geometry & MOs

Info

ID:	121072
PubChem CID:	50754997
Reduced:	ClO2N3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	293.093104
ΔH_f, kcal/mol:	-15.91
Dipole, Da:	5.56
IP(EA), eV:	-9.91(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)CNC(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations