Geometry & MOs

Info

ID:	374919
PubChem CID:	131349760
Reduced:	BrO2F4H5C9 (1)
Stoich.:	AB2C4D5E9 (1)
Weight, g/mol:	203.075785
ΔH_f, kcal/mol:	-268.69
Dipole, Da:	1.39
IP(EA), eV:	-10.48(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-amino-3,3-difluoropropyl)benzene-1,2-diol

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1C(F)(F)F)F)O)C(=O)CBr

DOS

IR

Vibrations