Geometry & MOs

Info

ID:	184224
PubChem CID:	77129765
Reduced:	ClFNO4H15C16 (1)
Stoich.:	ABCD4E15F16 (1)
Weight, g/mol:	230.00548
ΔH_f, kcal/mol:	-160.64
Dipole, Da:	5.18
IP(EA), eV:	-8.63(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(2-amino-5-bromophenyl)ethanol

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(C(=O)O)N)OCC2=C(C=CC=C2Cl)F

DOS

IR

Vibrations