Geometry & MOs

Info

ID:	20865
PubChem CID:	586208
Reduced:	OSN3C15H15 (1)
Stoich.:	ABC3D15E15 (1)
Weight, g/mol:	285.093583
ΔH_f, kcal/mol:	26.31
Dipole, Da:	2.98
IP(EA), eV:	-9.03(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethylanilino)-2-oxo-N-pyridin-2-ylethanimidothioic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)C(=NC2=CC=CC=N2)S

DOS

IR

Vibrations