Geometry & MOs

Info

ID:	207506
PubChem CID:	80406470
Reduced:	OSCl2N2H10C14 (1)
Stoich.:	ABC2D2E10F14 (1)
Weight, g/mol:	312.106312
ΔH_f, kcal/mol:	4.14
Dipole, Da:	7.02
IP(EA), eV:	-8.67(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-carbamothioyl-2-chlorophenyl)octanamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC2=C(C=CC(=C2)C(=S)N)Cl)Cl

DOS

IR

Vibrations