Geometry & MOs

Info

ID:	143221
PubChem CID:	53167091
Reduced:	ON4H18C21 (1)
Stoich.:	AB4C18D21 (1)
Weight, g/mol:	358.171499
ΔH_f, kcal/mol:	67.69
Dipole, Da:	3.35
IP(EA), eV:	-8.98(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexen-1-yl)ethyl]-2-methyl-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CN=CC=C1)NC(=O)C2=CN3C=C(N=C3C=C2)C4=CC=CC=C4

DOS

IR

Vibrations