Geometry & MOs

Info

ID:	406821
PubChem CID:	135078722
Reduced:	NOF4H11C18 (1)
Stoich.:	ABC4D11E18 (1)
Weight, g/mol:	232.119008
ΔH_f, kcal/mol:	-157.62
Dipole, Da:	2.97
IP(EA), eV:	-9.15(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(3-chlorophenyl)-9-borabicyclo[3.3.1]nonane

Drug info:

PubChemData

Smile

C1=CN(C=C1)C2=CC=C(C=C2)C(=O)C3=C(C=C(C=C3)F)C(F)(F)F

DOS

IR

Vibrations