Geometry & MOs

Info

ID:	269118
PubChem CID:	103614644
Reduced:	Br2N2O2C13H16 (1)
Stoich.:	A2B2C2D13E16 (1)
Weight, g/mol:	334.93434
ΔH_f, kcal/mol:	-60.7
Dipole, Da:	3.17
IP(EA), eV:	-9.34(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CNCC2=CC(=C(C(=C2)Br)O)Br

DOS

IR

Vibrations