Geometry & MOs

Info

ID:	209630
PubChem CID:	80696852
Reduced:	SN2O2Cl3H7C13 (1)
Stoich.:	AB2C2D3E7F13 (1)
Weight, g/mol:	252.220164
ΔH_f, kcal/mol:	-13.32
Dipole, Da:	3.41
IP(EA), eV:	-9.33(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-aminohexan-2-yl)-2-(2-bicyclo[2.2.1]heptanyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)Cl)NS(=O)(=O)C2=C(C=CC(=C2)C#N)Cl

DOS

IR

Vibrations