Geometry & MOs

Info

ID:	60619
PubChem CID:	26697291
Reduced:	O2N3C19H19 (1)
Stoich.:	A2B3C19D19 (1)
Weight, g/mol:	432.171893
ΔH_f, kcal/mol:	-21.51
Dipole, Da:	1.92
IP(EA), eV:	-8.7(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(4-ethylphenyl)hexanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC

DOS

IR

Vibrations