Geometry & MOs

Info

ID:	66368
PubChem CID:	46504456
Reduced:	N3O5C26H33 (1)
Stoich.:	A3B5C26D33 (1)
Weight, g/mol:	474.179087
ΔH_f, kcal/mol:	-204.68
Dipole, Da:	5.64
IP(EA), eV:	-8.15(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-methoxyanilino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-methylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC)NC(=O)C3CCCN3C(=O)OC(C)(C)C

DOS

IR

Vibrations