Geometry & MOs

Info

ID:	222024
PubChem CID:	85293480
Reduced:	FN3O5H20C26 (1)
Stoich.:	AB3C5D20E26 (1)
Weight, g/mol:	473.223364
ΔH_f, kcal/mol:	-122.38
Dipole, Da:	2.91
IP(EA), eV:	-9.64(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-[1-[tert-butyl(dimethyl)silyl]oxyethyl]-1-methyl-4,9-dioxo-10-oxa-5-azatricyclo[5.3.0.02,5]decane-6-carboxylate

Drug info:

PubChemData

Smile

C1C(N(C(=O)O1)C2C(N(C2=O)C(=O)OC3=CC=C(C=C3)F)C=CC4=CN=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations