Geometry & MOs

Info

ID:

319717

PubChem CID:

126657087

Reduced:

NOC5H7 (6)

Stoich.:

ABC5D7 (6)

Weight, g/mol:

529.162545

ΔHf, kcal/mol:

-232.57

Dipole, Da:

1.53

IP(EA), eV:

 -8.33(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[[[(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy-phenoxyphosphoryl]amino]-3-methylbutanoate

Drug info:

PubChemData

Smile

CCC(C)(C)CC(C)(C)COC1=CC=C(C=C1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)C2=CC(=CC=C2)N=C(N)N

DOS

IR

Vibrations