Geometry & MOs

Info

ID:	211833
PubChem CID:	81054372
Reduced:	OSN3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	350.00885
ΔH_f, kcal/mol:	-29.91
Dipole, Da:	3.01
IP(EA), eV:	-8.18(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromo-2-methylphenoxy)-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)OCCN2CCCCC2

DOS

IR

Vibrations