Geometry & MOs

Info

ID:	195129
PubChem CID:	78639906
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	345.060569
ΔH_f, kcal/mol:	17.54
Dipole, Da:	8.3
IP(EA), eV:	-7.94(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)C(=C1NC2CCCCC2N1)C#N)N3CCN(CC3)C4=CC=CC=C4

DOS

IR

Vibrations