Geometry & MOs

Info

ID:	276060
PubChem CID:	103820239
Reduced:	BrN2O3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	324.02219
ΔH_f, kcal/mol:	10.3
Dipole, Da:	4.83
IP(EA), eV:	-9.48(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromophenyl)-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])CNCC2=CC=C(O2)Br

DOS

IR

Vibrations