Geometry & MOs

Info

ID:	267898
PubChem CID:	103590221
Reduced:	FON2C12H19 (1)
Stoich.:	ABC2D12E19 (1)
Weight, g/mol:	235.11209
ΔH_f, kcal/mol:	-89.84
Dipole, Da:	3.06
IP(EA), eV:	-8.07(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-5-methyl-1-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzene-1,2-diamine

Drug info:

PubChemData

Smile

CCOCC(C)NC1=C(C=C(C(=C1)C)F)N

DOS

IR

Vibrations