Geometry & MOs

Info

ID:	284352
PubChem CID:	104045826
Reduced:	ClNS2C10H10 (1)
Stoich.:	ABC2D10E10 (1)
Weight, g/mol:	285.014576
ΔH_f, kcal/mol:	40.59
Dipole, Da:	2.36
IP(EA), eV:	-9.08(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenyl)methyl]-4-(3-chloropropyl)-1,3-thiazole

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=NC(=CS2)CCCCl

DOS

IR

Vibrations