Geometry & MOs

Info

ID:	232569
PubChem CID:	87576441
Reduced:	O2C19H38 (1)
Stoich.:	A2B19C38 (1)
Weight, g/mol:	445.170079
ΔH_f, kcal/mol:	-178.51
Dipole, Da:	1.5
IP(EA), eV:	-10.54(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-chloro-7-(furo[3,2-b]pyridin-6-ylmethyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-amine

Drug info:

PubChemData

Smile

CCCCCCCCCOC(=O)C(CCC)CCCCC

DOS

IR

Vibrations