Geometry & MOs

Info

ID:	157310
PubChem CID:	56422865
Reduced:	SN3O6C22H25 (1)
Stoich.:	AB3C6D22E25 (1)
Weight, g/mol:	355.141973
ΔH_f, kcal/mol:	-191.71
Dipole, Da:	6.69
IP(EA), eV:	-9.05(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-3-methoxy-4-prop-2-enoxybenzamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C4C(=CC=C3)OCCO4

DOS

IR

Vibrations