Geometry & MOs

Info

ID:	206850
PubChem CID:	80309512
Reduced:	SN2O3C12H12 (1)
Stoich.:	AB2C3D12E12 (1)
Weight, g/mol:	285.045964
ΔH_f, kcal/mol:	-40.55
Dipole, Da:	2.81
IP(EA), eV:	-8.83(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-thiazol-2-ylmethoxy)naphthalene-2-carboxylic acid

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C(=C2)CN)OCC3=NC=CS3

DOS

IR

Vibrations