Geometry & MOs

Info

ID:	436041
PubChem CID:	135193488
Reduced:	PO5C15H23 (1)
Stoich.:	AB5C15D23 (1)
Weight, g/mol:	262.050905
ΔH_f, kcal/mol:	-281.78
Dipole, Da:	3.07
IP(EA), eV:	-9.08(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-(2-chloropyrimidin-5-yl)acetate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CC=CC=C1C)P(=O)(OCC)OCC

DOS

IR

Vibrations