Geometry & MOs

Info

ID:	285850
PubChem CID:	104133997
Reduced:	ClO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	330.080491
ΔH_f, kcal/mol:	-83.13
Dipole, Da:	2.23
IP(EA), eV:	-9.77(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations