Geometry & MOs

Info

ID:	259270
PubChem CID:	103162365
Reduced:	BrO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	295.124215
ΔH_f, kcal/mol:	-87.5
Dipole, Da:	3.84
IP(EA), eV:	-8.75(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-cyclobutylacetyl)phenyl]propane-1-sulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(=O)CC2CCC2)Br)OC

DOS

IR

Vibrations