Geometry & MOs

Info

ID:	285821
PubChem CID:	104133916
Reduced:	ClSN2O3C14H19 (1)
Stoich.:	ABC2D3E14F19 (1)
Weight, g/mol:	351.9978
ΔH_f, kcal/mol:	-121.96
Dipole, Da:	0.99
IP(EA), eV:	-10.06(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-2-methylphenyl)-2-chloro-6-ethylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CC(=C1)C(=O)N(C)C2CCS(=O)(=O)C2)Cl

DOS

IR

Vibrations