Geometry & MOs

Info

ID:	401752
PubChem CID:	135052436
Reduced:	O8H22C29 (1)
Stoich.:	A8B22C29 (1)
Weight, g/mol:	281.192569
ΔH_f, kcal/mol:	-177.78
Dipole, Da:	6.83
IP(EA), eV:	-9.89(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-N-cyclohexyl-5-[2-(diethylamino)ethylidene]-4H-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

C#CC(=O)C1[C@@H]([C@@H]([C@H](O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations