Geometry & MOs

Info

ID:	58004
PubChem CID:	24398200
Reduced:	ClN3O3S3H16C17 (1)
Stoich.:	AB3C3D3E16F17 (1)
Weight, g/mol:	324.015783
ΔH_f, kcal/mol:	-34.12
Dipole, Da:	4.12
IP(EA), eV:	-8.9(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]cyclohex-3-ene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)C(=O)NC2=NC(=CS2)C3=CC=C(S3)Cl

DOS

IR

Vibrations