Geometry & MOs

Info

ID:	285819
PubChem CID:	104133914
Reduced:	ClON2C17H23 (1)
Stoich.:	ABC2D17E23 (1)
Weight, g/mol:	316.064841
ΔH_f, kcal/mol:	-53.63
Dipole, Da:	5.22
IP(EA), eV:	-9.54(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(1,1-dioxothiolan-3-yl)-6-ethyl-N-methylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)N2CCCC3C2CCCC3)Cl

DOS

IR

Vibrations