Geometry & MOs

Info

ID:	269284
PubChem CID:	103616719
Reduced:	NS2O3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	276.093249
ΔH_f, kcal/mol:	-80.26
Dipole, Da:	5.29
IP(EA), eV:	-9.43(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethylthiophen-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC(=O)C2=CC=C(S2)C(=O)O

DOS

IR

Vibrations