Geometry & MOs

Info

ID:	219968
PubChem CID:	85165096
Reduced:	NSSiO2C39H49 (1)
Stoich.:	ABCD2E39F49 (1)
Weight, g/mol:	626.206444
ΔH_f, kcal/mol:	-55.5
Dipole, Da:	5.16
IP(EA), eV:	-8.57(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-benzoyloxy-2-[[5-[[3-(4-fluorophenoxy)phenyl]methyl]-2,4-dioxo-1,3-diazinan-1-yl]methoxy]propyl] benzoate

Drug info:

PubChemData

Smile

CC1(C(N2C(=S)C(CCC2(O1)C)(CC=C)C(CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)C=C)C5=CC=CC=C5)C

DOS

IR

Vibrations