Geometry & MOs

Info

ID:	284091
PubChem CID:	104035168
Reduced:	N3C12H19 (1)
Stoich.:	A3B12C19 (1)
Weight, g/mol:	234.093918
ΔH_f, kcal/mol:	35.94
Dipole, Da:	4.37
IP(EA), eV:	-8.28(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyridine-2,4-diamine

Drug info:

PubChemData

Smile

CCN(CC1CC1)C2=CC(=NC=C2)NC

DOS

IR

Vibrations