Geometry & MOs

Info

ID:	213916
PubChem CID:	81065547
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	315.077658
ΔH_f, kcal/mol:	-162.67
Dipole, Da:	5.52
IP(EA), eV:	-9.42(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)N1CCCCCC1

DOS

IR

Vibrations