Geometry & MOs

Info

ID:	209283
PubChem CID:	80647596
Reduced:	O2N3C12H13 (1)
Stoich.:	A2B3C12D13 (1)
Weight, g/mol:	310.99194
ΔH_f, kcal/mol:	-6.86
Dipole, Da:	4.95
IP(EA), eV:	-8.98(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-(2-iodophenyl)pyridine-2,6-diamine

Drug info:

PubChemData

Smile

COCC1=CC(=CC=C1)OC2=NC(=CN=C2)N

DOS

IR

Vibrations