Geometry & MOs

Info

ID:	337636
PubChem CID:	127258259
Reduced:	BN2C26H33 (1)
Stoich.:	AB2C26D33 (1)
Weight, g/mol:	422.122499
ΔH_f, kcal/mol:	2.36
Dipole, Da:	1.3
IP(EA), eV:	-8.54(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[amino-(2,3,4,5,6-pentafluorophenyl)boranyl]-4-methoxy-N-(4-methoxyphenyl)aniline

Drug info:

PubChemData

Smile

B(C1=CC=CC=C1)(N)N(C(C2=CC=CC=C2)C(C)C)C(C3=CC=CC=C3)C(C)C

DOS

IR

Vibrations