Geometry & MOs

Info

ID:	378293
PubChem CID:	134224369
Reduced:	ClO2F3N4H12C15 (1)
Stoich.:	AB2C3D4E12F15 (1)
Weight, g/mol:	494.102507
ΔH_f, kcal/mol:	-164.26
Dipole, Da:	7.53
IP(EA), eV:	-9.48(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-ynyl (2S)-2-[[[(2R,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CN(C)C(=O)C(=O)C1=CC=CC=C1NC2=NC(=NC=C2C(F)(F)F)Cl

DOS

IR

Vibrations