Geometry & MOs

Info

ID:	36933
PubChem CID:	8015052
Reduced:	N2O5C19H24 (1)
Stoich.:	A2B5C19D24 (1)
Weight, g/mol:	418.156243
ΔH_f, kcal/mol:	-213.24
Dipole, Da:	5.2
IP(EA), eV:	-9.38(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-oxo-1-[4-(propan-2-ylsulfamoyl)anilino]propan-2-yl] 4-ethylbenzoate

Drug info:

PubChemData

Smile

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=CC=C(C=C2)CC)C(=O)OCC

DOS

IR

Vibrations