Geometry & MOs

Info

ID:	360469
PubChem CID:	127301114
Reduced:	S2O3N5C14H19 (1)
Stoich.:	A2B3C5D14E19 (1)
Weight, g/mol:	274.088832
ΔH_f, kcal/mol:	-62.14
Dipole, Da:	4.77
IP(EA), eV:	-8.84(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyano-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)cyclohex-3-ene-1-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(N3CCSC3=N2)C#N

DOS

IR

Vibrations