Geometry & MOs

Info

ID:	85444
PubChem CID:	49875250
Reduced:	ClS2N3O4H16C21 (1)
Stoich.:	AB2C3D4E16F21 (1)
Weight, g/mol:	180.089878
ΔH_f, kcal/mol:	-42.38
Dipole, Da:	4.04
IP(EA), eV:	-9.13(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(methoxymethyl)pyridin-2-yl]acetamide

Drug info:

PubChemData

Smile

CN1/C(=C(\NC2=CC=CC(=N2)/C=C/C3=CC=CC=C3)/O)/C(=O)C4=C(S1(=O)=O)C=C(S4)Cl

DOS

IR

Vibrations