Geometry & MOs

Info

ID:	212558
PubChem CID:	81060980
Reduced:	SO2N3C11H15 (1)
Stoich.:	AB2C3D11E15 (1)
Weight, g/mol:	289.104897
ΔH_f, kcal/mol:	-62.6
Dipole, Da:	2.52
IP(EA), eV:	-8.72(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-fluorophenyl)methylamino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NCC(=O)OC

DOS

IR

Vibrations