Geometry & MOs

Info

ID:	209066
PubChem CID:	80618973
Reduced:	FSO2N4C13H15 (1)
Stoich.:	ABC2D4E13F15 (1)
Weight, g/mol:	325.103103
ΔH_f, kcal/mol:	-60.88
Dipole, Da:	6.07
IP(EA), eV:	-8.54(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-5-(propylamino)-1,3,4-thiadiazole-2-carboxamide

Drug info:

PubChemData

Smile

CCCNC1=NN=C(S1)C(=O)NC2=C(C=C(C=C2)F)OC

DOS

IR

Vibrations