Geometry & MOs

Info

ID:	56340
PubChem CID:	17425131
Reduced:	FO2N3C16H24 (1)
Stoich.:	AB2C3D16E24 (1)
Weight, g/mol:	363.050965
ΔH_f, kcal/mol:	-110.46
Dipole, Da:	3.67
IP(EA), eV:	-8.44(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methoxyanilino)-2-oxoethyl] 7-chloro-1,3-benzodioxole-5-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)N1CCN(CC1)C2=CC=C(C=C2)F

DOS

IR

Vibrations