Geometry & MOs

Info

ID:	372745
PubChem CID:	131303860
Reduced:	BrOSC13H15 (1)
Stoich.:	ABCD13E15 (1)
Weight, g/mol:	264.99138
ΔH_f, kcal/mol:	-21.13
Dipole, Da:	0.59
IP(EA), eV:	-8.63(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1R)-1-amino-3,3-difluoropropyl]-2-bromophenol

Drug info:

PubChemData

Smile

CCC1=C2C(=CC(=C1OCC)CBr)C=CS2

DOS

IR

Vibrations