Geometry & MOs

Info

ID:	60693
PubChem CID:	26697428
Reduced:	NSO5C16H21 (1)
Stoich.:	ABC5D16E21 (1)
Weight, g/mol:	380.176979
ΔH_f, kcal/mol:	-196.58
Dipole, Da:	6.59
IP(EA), eV:	-9.41(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[3-(tert-butylsulfamoyl)-4-methoxyphenyl]-N-cyclopentylprop-2-enamide

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations