Geometry & MOs

Info

ID:	271587
PubChem CID:	103684669
Reduced:	ClNOSC5H5 (2)
Stoich.:	ABCDE5F5 (2)
Weight, g/mol:	254.145285
ΔH_f, kcal/mol:	1.0
Dipole, Da:	4.35
IP(EA), eV:	-9.05(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-ethyl-1,3-thiazol-4-yl)methylamino]cyclohexyl]methanol

Drug info:

PubChemData

Smile

C#CCSCCNS(=O)(=O)C1=CC(=C(N=C1)Cl)Cl

DOS

IR

Vibrations