Geometry & MOs

Info

ID:	39765
PubChem CID:	8142211
Reduced:	ClN3O4C12H14 (1)
Stoich.:	AB3C4D12E14 (1)
Weight, g/mol:	369.135842
ΔH_f, kcal/mol:	-85.5
Dipole, Da:	2.0
IP(EA), eV:	-10.02(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-morpholin-4-ylsulfonyl-N-[2-oxo-2-(propylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

CCCNC(=O)CNC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl

DOS

IR

Vibrations