Geometry & MOs

Info

ID:	212294
PubChem CID:	81060051
Reduced:	SN3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	303.120547
ΔH_f, kcal/mol:	38.27
Dipole, Da:	5.51
IP(EA), eV:	-8.34(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(N-ethyl-2-fluoroanilino)-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)C)C2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations