Geometry & MOs

Info

ID:	225118
PubChem CID:	85741812
Reduced:	NO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	661.976914
ΔH_f, kcal/mol:	-122.98
Dipole, Da:	4.05
IP(EA), eV:	-9.59(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[2,6-difluoro-3,4,5-tris(trifluoromethyl)phenyl]borinic acid

Drug info:

PubChemData

Smile

CC1CCCN2C1(CCCC2=O)O

DOS

IR

Vibrations