Geometry & MOs

Info

ID:

45118

PubChem CID:

10508168

Reduced:

NSSiO2C39H49 (1)

Stoich.:

ABCD2E39F49 (1)

Weight, g/mol:

623.185481

ΔHf, kcal/mol:

-60.28

Dipole, Da:

3.39

IP(EA), eV:

 -8.48(-0.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

8-chloro-N-[3-[3-[(8-chloroacridine-4-carbonyl)amino]propyl-methylamino]propyl]acridine-4-carboxamide

Drug info:

PubChemData

Smile

C[C@]12CC[C@](C(=S)N1[C@@H](C(O2)(C)C)C3=CC=CC=C3)(CC=C)[C@H](CO[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C)C=C

DOS

IR

Vibrations