Geometry & MOs

Info

ID:	268241
PubChem CID:	103598562
Reduced:	O3N5C21H23 (1)
Stoich.:	A3B5C21D23 (1)
Weight, g/mol:	380.176979
ΔH_f, kcal/mol:	21.53
Dipole, Da:	6.11
IP(EA), eV:	-9.47(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(3-ethoxypiperidin-1-yl)-3-oxoprop-1-enyl]-N-propan-2-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCOC1CCCN(C1)C(=O)C(=CC2=CC=CO2)N3C(=NN=N3)C4=CC=CC=C4

DOS

IR

Vibrations