Geometry & MOs

Info

ID:	64975
PubChem CID:	29204280
Reduced:	Cl3O3N4H15C17 (1)
Stoich.:	A3B3C4D15E17 (1)
Weight, g/mol:	394.99951
ΔH_f, kcal/mol:	-9.75
Dipole, Da:	9.43
IP(EA), eV:	-9.08(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-phenyl-N'-(2,4,6-trichlorophenyl)-1,2-oxazole-4-carbohydrazide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NNC3=C(C=C(C=C3Cl)Cl)Cl

DOS

IR

Vibrations