Geometry & MOs

Info

ID:	272503
PubChem CID:	103744014
Reduced:	NOC3H5 (3)
Stoich.:	ABC3D5 (3)
Weight, g/mol:	325.0062
ΔH_f, kcal/mol:	-74.15
Dipole, Da:	5.87
IP(EA), eV:	-10.24(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-methoxy-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CCCOCC(=O)NCCC1=NC=NO1

DOS

IR

Vibrations