Geometry & MOs

Info

ID:

54049

PubChem CID:

14719774

Reduced:

SiCl2N2O3C25H36 (1)

Stoich.:

AB2C2D3E25F36 (1)

Weight, g/mol:

514.145754

ΔHf, kcal/mol:

-160.92

Dipole, Da:

4.53

IP(EA), eV:

 -9.12(-0.74)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6,7-dichloro-2,3-dihydro-1-benzofuran-5-yl]-[2-(2-methoxyethoxymethyl)pyrazol-3-yl]methanone

Drug info:

PubChemData

Smile

CCCCCCN1C(=CC=N1)C(=O)C2=C(C(=C3C(=C2)CC(O3)CO[Si](C)(C)C(C)(C)C)Cl)Cl

DOS

IR

Vibrations