Geometry & MOs

Info

ID:	33249
PubChem CID:	7885640
Reduced:	N3O6C18H25 (1)
Stoich.:	A3B6C18D25 (1)
Weight, g/mol:	363.125277
ΔH_f, kcal/mol:	-249.28
Dipole, Da:	8.71
IP(EA), eV:	-9.09(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)O[C@@H](C)C(=O)NC(=O)NC

DOS

IR

Vibrations