Geometry & MOs

Info

ID:	190684
PubChem CID:	78042444
Reduced:	SiF2O3N4C19H30 (1)
Stoich.:	AB2C3D4E19F30 (1)
Weight, g/mol:	569.160627
ΔH_f, kcal/mol:	-250.19
Dipole, Da:	1.32
IP(EA), eV:	-8.7(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[1-[5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-4-fluoro-4-methyloxolan-2-yl]ethoxy-(2-chlorophenoxy)phosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CC(C1C(C(C(O1)N2C=C(C3=C(N=CN=C32)N)F)(C)F)O[Si](C)(C)C(C)(C)C)O

DOS

IR

Vibrations