Geometry & MOs

Info

ID:	393363
PubChem CID:	135020320
Reduced:	NOC17H19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	355.124215
ΔH_f, kcal/mol:	-26.54
Dipole, Da:	4.32
IP(EA), eV:	-8.78(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[(Z)-4-(3-phenylprop-2-ynoxy)but-2-enyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CC2C(C3=CC=CC=C3C=C2C1)N4CCCC4=O

DOS

IR

Vibrations