Geometry & MOs

Info

ID:	291754
PubChem CID:	113469296
Reduced:	SCl2N2O2C10H12 (1)
Stoich.:	AB2C2D2E10F12 (1)
Weight, g/mol:	256.084792
ΔH_f, kcal/mol:	-50.41
Dipole, Da:	5.48
IP(EA), eV:	-9.02(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-formylpyridin-3-yl)oxyphenyl]acetamide

Drug info:

PubChemData

Smile

C1CC1CNS(=O)(=O)C2=C(C(=C(C=C2)Cl)N)Cl

DOS

IR

Vibrations