Geometry & MOs

Info

ID:	37481
PubChem CID:	8021506
Reduced:	Cl2N2O5H12C16 (1)
Stoich.:	A2B2C5D12E16 (1)
Weight, g/mol:	381.028311
ΔH_f, kcal/mol:	-147.95
Dipole, Da:	1.64
IP(EA), eV:	-8.48(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)NC(=O)COC(=O)C3=CC(=C(N=C3)Cl)Cl

DOS

IR

Vibrations