Geometry & MOs

Info

ID:	54685
PubChem CID:	17389096
Reduced:	SN3O4H17C18 (1)
Stoich.:	AB3C4D17E18 (1)
Weight, g/mol:	343.062677
ΔH_f, kcal/mol:	-134.77
Dipole, Da:	9.14
IP(EA), eV:	-8.28(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-amino-6-methylthieno[2,3-b]pyridine-2-carbonyl)amino]-2-hydroxybenzoic acid

Drug info:

PubChemData

Smile

CC1=C(C2=C(N=C1C)SC(=C2N)C(=O)NC3=CC(=C(C=C3)O)C(=O)O)C

DOS

IR

Vibrations