Geometry & MOs

Info

ID:	29366
PubChem CID:	833379
Reduced:	OSCl2N2C12H14 (1)
Stoich.:	ABC2D2E12F14 (1)
Weight, g/mol:	294.086056
ΔH_f, kcal/mol:	-33.84
Dipole, Da:	4.22
IP(EA), eV:	-8.65(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexen-1-yl)ethylcarbamothioyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=S)NC(=O)C1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations