Geometry & MOs

Info

ID:	284681
PubChem CID:	104060753
Reduced:	OSN3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	249.093583
ΔH_f, kcal/mol:	13.74
Dipole, Da:	1.3
IP(EA), eV:	-8.54(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propoxy-N-(1,3-thiazol-2-ylmethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CCOC1=C(N=CC=C1)NCC2=CSC(=N2)C

DOS

IR

Vibrations