Geometry & MOs

Info

ID:	250463
PubChem CID:	103096853
Reduced:	F3N3C14H14 (1)
Stoich.:	A3B3C14D14 (1)
Weight, g/mol:	279.093853
ΔH_f, kcal/mol:	-79.16
Dipole, Da:	1.23
IP(EA), eV:	-8.71(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-[(2-chloro-4-fluorophenyl)methyl]-2-N,2-N-dimethylpyridine-2,3-diamine

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=N1)NCC2=CC(=C(C=C2F)F)F

DOS

IR

Vibrations