Geometry & MOs

Info

ID:	439704
PubChem CID:	135229507
Reduced:	N2C7H7 (2)
Stoich.:	A2B7C7 (2)
Weight, g/mol:	903.350115
ΔH_f, kcal/mol:	83.09
Dipole, Da:	5.65
IP(EA), eV:	-8.26(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3,5-triphenyl-N-[4-(4-spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-fluorene]-2'-ylphenyl)phenyl]aniline

Drug info:

PubChemData

Smile

CC1=NC=CC(=C1)C2=NNC3=C2C=C(C=C3)NC

DOS

IR

Vibrations