Geometry & MOs

Info

ID:	341905
PubChem CID:	127264598
Reduced:	BrClNC8H15 (1)
Stoich.:	ABCD8E15 (1)
Weight, g/mol:	182.091438
ΔH_f, kcal/mol:	-61.75
Dipole, Da:	3.64
IP(EA), eV:	-9.54(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-fluoro-3-propan-2-ylphenyl)boronic acid

Drug info:

PubChemData

Smile

C1CC2(CCC1(CC2)N)Br.Cl

DOS

IR

Vibrations