Geometry & MOs

Info

ID:	338216
PubChem CID:	127258908
Reduced:	BrClOF2N2C7H8 (1)
Stoich.:	ABCD2E2F7G8 (1)
Weight, g/mol:	306.107313
ΔH_f, kcal/mol:	-140.75
Dipole, Da:	4.05
IP(EA), eV:	-9.26(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]methanamine;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Br)NN)OC(F)F.Cl

DOS

IR

Vibrations