Geometry & MOs

Info

ID:	268938
PubChem CID:	103602694
Reduced:	Cl2N2O5H8C10 (1)
Stoich.:	A2B2C5D8E10 (1)
Weight, g/mol:	352.9449
ΔH_f, kcal/mol:	-189.53
Dipole, Da:	5.12
IP(EA), eV:	-10.4(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dibromo-4-[(3-methoxypropylamino)methyl]phenol

Drug info:

PubChemData

Smile

C1=C(C=C(N=C1Cl)Cl)C(=O)NC(CC(=O)O)C(=O)O

DOS

IR

Vibrations