Geometry & MOs

Info

ID:

163454

PubChem CID:

57969350

Reduced:

FSiO3N4C32H39 (1)

Stoich.:

ABC3D4E32F39 (1)

Weight, g/mol:

560.273129

ΔHf, kcal/mol:

-117.69

Dipole, Da:

6.79

IP(EA), eV:

 -8.62(-0.88)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[(4-fluorophenyl)methyl]-7-methyl-5-(2H-tetrazol-5-ylmethyl)-9-tri(propan-2-yl)silyloxy-6H-pyrrolo[3,4-g]quinolin-8-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2=C3C=C(C=NC3=C(C4=C2CN(C4=O)C)O[Si](C(C)C)(C(C)C)C(C)C)CC5=CC=C(C=C5)F

DOS

IR

Vibrations