Geometry & MOs

Info

ID:	373102
PubChem CID:	131309951
Reduced:	ON2C10H10 (1)
Stoich.:	AB2C10D10 (1)
Weight, g/mol:	250.97573
ΔH_f, kcal/mol:	24.67
Dipole, Da:	2.52
IP(EA), eV:	-9.03(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-2-(2-bromo-3,4-difluorophenyl)ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C=C/C(C#N)N)O

DOS

IR

Vibrations