Geometry & MOs

Info

ID:	38002
PubChem CID:	8026317
Reduced:	N3O7C20H23 (1)
Stoich.:	A3B7C20D23 (1)
Weight, g/mol:	353.96583
ΔH_f, kcal/mol:	-255.78
Dipole, Da:	4.72
IP(EA), eV:	-9.37(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(2-bromophenoxy)methyl]-6-chloro-4H-1,3-benzodioxine

Drug info:

PubChemData

Smile

CCOC(=O)N1CCN(CC1)C(=O)COC(=O)C2=C(OCC2=O)NC3=CC=CC=C3

DOS

IR

Vibrations