Geometry & MOs

Info

ID:	440123
PubChem CID:	135230023
Reduced:	O2N3C13H23 (1)
Stoich.:	A2B3C13D23 (1)
Weight, g/mol:	428.067606
ΔH_f, kcal/mol:	-74.24
Dipole, Da:	3.18
IP(EA), eV:	-8.38(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-[benzenesulfonyl(ethenyl)amino]ethylsulfanyl]-2,6-difluorophenoxy]acetamide

Drug info:

PubChemData

Smile

C/C=C\C(=C/C)\N1CCN(CC1)CC(=O)NCO

DOS

IR

Vibrations