Geometry & MOs

Info

ID:	309318
PubChem CID:	126544559
Reduced:	FC27H35 (1)
Stoich.:	AB27C35 (1)
Weight, g/mol:	493.125016
ΔH_f, kcal/mol:	-62.37
Dipole, Da:	1.47
IP(EA), eV:	-8.85(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-ethynyl-2-(hydroxymethyl)oxolan-3-yl]oxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C=C(C=C3)C4CCCCC4)F

DOS

IR

Vibrations