Geometry & MOs

Info

ID:

429146

PubChem CID:

135168934

Reduced:

NH27C39 (1)

Stoich.:

AB27C39 (1)

Weight, g/mol:

721.27695

ΔHf, kcal/mol:

160.84

Dipole, Da:

0.94

IP(EA), eV:

 -8.0(-0.59)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2'-(9,9-diphenylfluoren-3-yl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)NC5=CC6=C(C=C5)C7=CC=CC=C7C=C6)C8=CC=CC=C8

DOS

IR

Vibrations