Geometry & MOs

Info

ID:	292345
PubChem CID:	114917273
Reduced:	OCl2N3C12H15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	328.977025
ΔH_f, kcal/mol:	-31.58
Dipole, Da:	3.82
IP(EA), eV:	-9.01(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dichloro-N-(2-fluoro-5-nitrophenyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CN1CCC(CC1)NC(=O)C2=CC(=NC=C2Cl)Cl

DOS

IR

Vibrations