Geometry & MOs

Info

ID:	249457
PubChem CID:	103089615
Reduced:	FNSO2Cl3C13H13 (1)
Stoich.:	ABCD2E3F13G13 (1)
Weight, g/mol:	282.122441
ΔH_f, kcal/mol:	-38.63
Dipole, Da:	7.11
IP(EA), eV:	-9.52(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-4-methylsulfanylbutyl]cyclopropanamine

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2S(=O)(=O)C3=C(C(=C(C=C3)Cl)F)Cl)Cl

DOS

IR

Vibrations