Geometry & MOs

Info

ID:	392938
PubChem CID:	135018580
Reduced:	SiN2O7C32H41 (1)
Stoich.:	AB2C7D32E41 (1)
Weight, g/mol:	453.129791
ΔH_f, kcal/mol:	-242.21
Dipole, Da:	3.53
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.274452
Charge, e:	1

Chem-info

IUPAC name:

2-ethyl-1,4,10-trihydroxy-6,9-bis(methoxymethoxy)-5-oxobenzo[b]fluorene-11-diazonium

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)OC1=CC2(C(C3=C1C4=C(C5=C(C(=CC=C5)OCOC)C(=O)C4=C3[N+]#N)O)OC(O2)(C)C)C

DOS

IR

Vibrations