Geometry & MOs

Info

ID:	63555
PubChem CID:	26758612
Reduced:	NF3O4H16C19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	468.153049
ΔH_f, kcal/mol:	-262.97
Dipole, Da:	2.34
IP(EA), eV:	-9.41(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[5-(diethylsulfamoyl)-2-methylphenyl]-3-[4-(difluoromethoxy)-3-methoxyphenyl]prop-2-enamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C(C=CC=C1F)F)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations