Geometry & MOs

Info

ID:	261201
PubChem CID:	103222228
Reduced:	ClINOSC12H15 (1)
Stoich.:	ABCDEF12G15 (1)
Weight, g/mol:	429.91367
ΔH_f, kcal/mol:	-25.27
Dipole, Da:	3.04
IP(EA), eV:	-8.67(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-iodophenyl)-4-(2-chlorophenyl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

CCSCC(C)NC(=O)C1=CC(=C(C=C1)I)Cl

DOS

IR

Vibrations