Geometry & MOs

Info

ID:	212397
PubChem CID:	81060409
Reduced:	SCl2N3H13C14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	287.109233
ΔH_f, kcal/mol:	30.32
Dipole, Da:	3.44
IP(EA), eV:	-8.78(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methoxyanilino)-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NC2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations