Geometry & MOs

Info

ID:	149911
PubChem CID:	53789593
Reduced:	FNPSiO5C44H45 (1)
Stoich.:	ABCDE5F44G45 (1)
Weight, g/mol:	200.104859
ΔH_f, kcal/mol:	-181.74
Dipole, Da:	8.74
IP(EA), eV:	-9.09(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1,5-dioxacycloundecane-6,11-dione

Drug info:

PubChemData

Smile

CC1=C(C(=C(N=C1C2=CC=CC=C2)C3CC3)C#CP(=O)(C[C@H](CC(=O)O)O[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C)OC)C6=CC=C(C=C6)F

DOS

IR

Vibrations