Geometry & MOs

Info

ID:	260991
PubChem CID:	103213143
Reduced:	ClNO2F3C9H11 (1)
Stoich.:	ABC2D3E9F11 (1)
Weight, g/mol:	361.96829
ΔH_f, kcal/mol:	-227.58
Dipole, Da:	3.4
IP(EA), eV:	-9.92(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(3-chloro-4-iodophenyl)-1,3-oxazol-2-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

C1=C(OC(=N1)CCCCl)COCC(F)(F)F

DOS

IR

Vibrations