Geometry & MOs

Info

ID:	259257
PubChem CID:	103162296
Reduced:	NSCl3O3C13H14 (1)
Stoich.:	ABC3D3E13F14 (1)
Weight, g/mol:	317.048857
ΔH_f, kcal/mol:	-132.73
Dipole, Da:	8.51
IP(EA), eV:	-9.89(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-cyclobutylacetyl)amino]-2-methoxybenzenesulfonyl chloride

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1S(=O)(=O)Cl)Cl)NC(=O)CC2CCC2)Cl

DOS

IR

Vibrations