Geometry & MOs

Info

ID:	361976
PubChem CID:	127304988
Reduced:	FO2N3C19H26 (1)
Stoich.:	AB2C3D19E26 (1)
Weight, g/mol:	378.154804
ΔH_f, kcal/mol:	-127.38
Dipole, Da:	5.65
IP(EA), eV:	-8.74(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-[(1-ethylpiperidin-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CCN1CCCCC1CNC(=O)C2CC(=O)N(C2)C3=CC=CC=C3F

DOS

IR

Vibrations