Geometry & MOs

Info

ID:	403569
PubChem CID:	135060893
Reduced:	NC23H27 (1)
Stoich.:	AB23C27 (1)
Weight, g/mol:	371.158886
ΔH_f, kcal/mol:	45.99
Dipole, Da:	2.52
IP(EA), eV:	-8.24(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-8-(benzenesulfinyl)-N,N-diethyloct-1-ene-1-sulfonamide

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)N2C3=CC=CC=C3C=C2C4CC4

DOS

IR

Vibrations