Geometry & MOs

Info

ID:	49460
PubChem CID:	11533052
Reduced:	Si2O3N5C22H39 (1)
Stoich.:	A2B3C5D22E39 (1)
Weight, g/mol:	478.10123
ΔH_f, kcal/mol:	-177.91
Dipole, Da:	1.33
IP(EA), eV:	-8.79(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-butoxyphenyl)-1,5-dihydroxy-4,8-dinitroanthracene-9,10-dione

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCC1=C[C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations