Geometry & MOs

Info

ID:	270480
PubChem CID:	103636750
Reduced:	N3O3C7H11 (1)
Stoich.:	A3B3C7D11 (1)
Weight, g/mol:	310.046882
ΔH_f, kcal/mol:	-77.03
Dipole, Da:	3.34
IP(EA), eV:	-10.42(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC(=O)OC

DOS

IR

Vibrations