Geometry & MOs

Info

ID:	139696
PubChem CID:	52581307
Reduced:	N3O4C28H33 (1)
Stoich.:	A3B4C28D33 (1)
Weight, g/mol:	324.067698
ΔH_f, kcal/mol:	-92.99
Dipole, Da:	7.46
IP(EA), eV:	-8.19(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-fluoro-N-[6-(2-methoxyethoxy)pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)[C@H](CNC(=O)[C@@H]2CCCN2C(=O)C3CC3)C4=CNC5=CC=CC=C54)OC

DOS

IR

Vibrations