Geometry & MOs

Info

ID:	211816
PubChem CID:	81054289
Reduced:	SN3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	276.073262
ΔH_f, kcal/mol:	-14.14
Dipole, Da:	4.03
IP(EA), eV:	-8.57(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1CCCC(C1)NC2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations