Geometry & MOs

Info

ID:	37498
PubChem CID:	8021618
Reduced:	Cl2N2O5H14C17 (1)
Stoich.:	A2B2C5D14E17 (1)
Weight, g/mol:	319.012661
ΔH_f, kcal/mol:	-154.25
Dipole, Da:	3.24
IP(EA), eV:	-8.56(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(ethylcarbamoylamino)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC2=C(C=C1)OCCO2)OC(=O)C3=CC(=C(N=C3)Cl)Cl

DOS

IR

Vibrations