Geometry & MOs

Info

ID:	263908
PubChem CID:	103406681
Reduced:	ClNOSC11H18 (1)
Stoich.:	ABCDE11F18 (1)
Weight, g/mol:	272.020869
ΔH_f, kcal/mol:	-43.25
Dipole, Da:	1.01
IP(EA), eV:	-8.91(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-methylthiophen-2-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine

Drug info:

PubChemData

Smile

CCCNC(COC)C1=C(C(=CS1)C)Cl

DOS

IR

Vibrations