Geometry & MOs

Info

ID:

163885

PubChem CID:

74380610

Reduced:

SiN2O9C39H74 (1)

Stoich.:

AB2C9D39E74 (1)

Weight, g/mol:

429.169999

ΔHf, kcal/mol:

-496.2

Dipole, Da:

7.16

IP(EA), eV:

 -8.37(0.74)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4-methoxyphenyl)methyl 4-[2-fluoro-4-[3-(hydroxyamino)-3-oxoprop-1-enyl]phenyl]piperazine-1-carboxylate

Drug info:

PubChemData

Smile

CCC1C(C2C(CN(CC(=C)CO2)C(CC(C(C(C(C(C(=O)O1)C)O)C)OC3C(C(CC(O3)C)N(C)C)O[Si](CC)(CC)CC)(C)O)C)C)(C)O

DOS

IR

Vibrations