Geometry & MOs

Info

ID:	183881
PubChem CID:	77084673
Reduced:	FN2O4C19H23 (1)
Stoich.:	AB2C4D19E23 (1)
Weight, g/mol:	276.104482
ΔH_f, kcal/mol:	-198.5
Dipole, Da:	2.41
IP(EA), eV:	-9.71(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-2-pyridin-4-ylacetamide

Drug info:

PubChemData

Smile

CN1CC2(CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)F)OCC1=O

DOS

IR

Vibrations