Geometry & MOs

Info

ID:	370359
PubChem CID:	127338222
Reduced:	ClO3N4C17H19 (1)
Stoich.:	AB3C4D17E19 (1)
Weight, g/mol:	349.119319
ΔH_f, kcal/mol:	-64.01
Dipole, Da:	6.1
IP(EA), eV:	-9.88(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C1=NOC(=N1)C2CCC(=O)NC2)NC(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations