Geometry & MOs

Info

ID:	62503
PubChem CID:	26719812
Reduced:	FSN2O4C18H19 (1)
Stoich.:	ABC2D4E18F19 (1)
Weight, g/mol:	283.991946
ΔH_f, kcal/mol:	-166.31
Dipole, Da:	10.39
IP(EA), eV:	-8.77(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dichloro-N-(3-fluorophenyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC3=CC(=CC=C3)F

DOS

IR

Vibrations