Geometry & MOs

Info

ID:	146986
PubChem CID:	53776921
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	247.041548
ΔH_f, kcal/mol:	-45.58
Dipole, Da:	3.64
IP(EA), eV:	-8.1(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-oxo-N-(pyridin-2-ylmethylideneamino)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)OC1C=CN2C=CC=CC2=C1

DOS

IR

Vibrations