Geometry & MOs

Info

ID:

190685

PubChem CID:

78042445

Reduced:

ClFPN5O6C24H30 (1)

Stoich.:

ABCD5E6F24G30 (1)

Weight, g/mol:

581.240321

ΔHf, kcal/mol:

-327.24

Dipole, Da:

4.12

IP(EA), eV:

 -8.55(-0.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

propan-2-yl 2-[[1-[5-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-4-methyloxolan-2-yl]ethoxy-naphthalen-1-yloxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)NP(=O)(OC1=CC=CC=C1Cl)OC(C)C2CC(C(O2)N3C=CC4=C(N=CN=C43)N)(C)F

DOS

IR

Vibrations