Geometry & MOs

Info

ID:

52913

PubChem CID:

14709196

Reduced:

B2N2O4C33H34 (1)

Stoich.:

A2B2C4D33E34 (1)

Weight, g/mol:

571.306519

ΔHf, kcal/mol:

-167.98

Dipole, Da:

6.41

IP(EA), eV:

 -8.73(-1.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N,N-dimethylaniline;9,9,18,18-tetramethyl-6,15-diphenyl-5,7,14,16-tetraoxa-6,15-diborapentacyclo[10.6.0.03,10.04,8.013,17]octadeca-1(12),2,10-triene

Drug info:

PubChemData

Smile

B1(OC2C(O1)C(C3=CC4=C(C=C23)C(C5C4OB(O5)C6=CC=CC=C6)(C)C)(C)C)C7=CC=CC=C7.C1=CN=CC=C1N

DOS

IR

Vibrations