Geometry & MOs

Info

ID:

298662

PubChem CID:

117653702

Reduced:

N8O9C45H54 (1)

Stoich.:

A8B9C45D54 (1)

Weight, g/mol:

729.278013

ΔHf, kcal/mol:

-314.61

Dipole, Da:

8.07

IP(EA), eV:

 -8.36(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

10-(4,6-diphenylpyrimidin-2-yl)-3,6-diphenylspiro[acridine-9,9'-xanthene]

Drug info:

PubChemData

Smile

CC[C@H]1CC[C@H](N1C(=O)[C@H](C(C)OC)NC(=O)OC)C2=NC3=C(N2)C=CC4=CC5=C(C=C43)OCC6=C5C=CC(=C6)C7=CN=C(N7)[C@@H]8CC[C@@H](N8C(=O)[C@H]([C@@H](C)OC)NC(=O)O)C

DOS

IR

Vibrations