Geometry & MOs

Info

ID:	55551
PubChem CID:	17395531
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	284.061949
ΔH_f, kcal/mol:	-111.63
Dipole, Da:	3.18
IP(EA), eV:	-9.21(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-anilino-1,3-thiazol-4-yl)benzene-1,3-diol

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCC2=CC=CC=N2

DOS

IR

Vibrations