Geometry & MOs

Info

ID:	139132
PubChem CID:	52478890
Reduced:	OSN4C22H26 (1)
Stoich.:	ABC4D22E26 (1)
Weight, g/mol:	423.936517
ΔH_f, kcal/mol:	54.48
Dipole, Da:	4.49
IP(EA), eV:	-8.68(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5,6-dichloropyridine-3-carbonyl)oxypropyl 5,6-dichloropyridine-3-carboxylate

Drug info:

PubChemData

Smile

C1COCCN1C2=NN=C(N2CC3=CC=CC=C3)SCCCC4=CC=CC=C4

DOS

IR

Vibrations