Geometry & MOs

Info

ID:	232406
PubChem CID:	87576133
Reduced:	OTeC11H12 (1)
Stoich.:	ABC11D12 (1)
Weight, g/mol:	498.166551
ΔH_f, kcal/mol:	-12.9
Dipole, Da:	3.44
IP(EA), eV:	-7.97(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-chloro-7-[(2,2-difluoro-4-methyl-1,3-benzodioxol-5-yl)methyl]-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)OC1=C2C=C[Te]C2=CC=C1

DOS

IR

Vibrations