Geometry & MOs

Info

ID:	211851
PubChem CID:	81054435
Reduced:	OSN2C16H18 (1)
Stoich.:	ABC2D16E18 (1)
Weight, g/mol:	294.063841
ΔH_f, kcal/mol:	2.78
Dipole, Da:	3.6
IP(EA), eV:	-8.15(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-difluorophenoxy)-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)OC(C)C2=CC=CC=C2

DOS

IR

Vibrations