Geometry & MOs

Info

ID:	165745
PubChem CID:	74591064
Reduced:	NO4C20H21 (1)
Stoich.:	AB4C20D21 (1)
Weight, g/mol:	343.121986
ΔH_f, kcal/mol:	-104.74
Dipole, Da:	4.72
IP(EA), eV:	-8.55(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3-fluoro-4-methoxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)C=CC(=O)NCC2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations