Geometry & MOs

Info

ID:	267746
PubChem CID:	103587541
Reduced:	ClF2N3C12H12 (1)
Stoich.:	AB2C3D12E12 (1)
Weight, g/mol:	293.097583
ΔH_f, kcal/mol:	-40.61
Dipole, Da:	7.56
IP(EA), eV:	-9.76(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(2,5-difluoro-4-methylphenyl)-1-N-methyl-2-nitrobenzene-1,3-diamine

Drug info:

PubChemData

Smile

CCCC1=NN=C(N1C2=C(C=C(C(=C2)F)C)F)Cl

DOS

IR

Vibrations