Geometry & MOs

Info

ID:	205371
PubChem CID:	80092470
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	273.073597
ΔH_f, kcal/mol:	-50.48
Dipole, Da:	3.78
IP(EA), eV:	-9.07(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylpyridin-3-yl)-5-fluoro-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)NC(=O)CCC(C)(C)N)C

DOS

IR

Vibrations