Geometry & MOs

Info

ID:	127319
PubChem CID:	50998197
Reduced:	FNBr2O2H4C7 (1)
Stoich.:	ABC2D2E4F7 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	-105.09
Dipole, Da:	6.25
IP(EA), eV:	-9.3(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxyethylamino)-3-(N-phenylanilino)propan-2-ol

Drug info:

PubChemData

Smile

C1=C(C(=C(C(=C1Br)N)Br)C(=O)O)F

DOS

IR

Vibrations