Geometry & MOs

Info

ID:	294399
PubChem CID:	117458953
Reduced:	SCl2O4C9H10 (1)
Stoich.:	AB2C4D9E10 (1)
Weight, g/mol:	283.9619
ΔH_f, kcal/mol:	-164.06
Dipole, Da:	5.34
IP(EA), eV:	-9.05(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromo-6-methylsulfanylphenyl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1CS(=O)(=O)Cl)Cl)O)OC

DOS

IR

Vibrations