Geometry & MOs

Info

ID:	33268
PubChem CID:	7885739
Reduced:	ClN2O5C21H23 (1)
Stoich.:	AB2C5D21E23 (1)
Weight, g/mol:	371.130363
ΔH_f, kcal/mol:	-180.89
Dipole, Da:	4.18
IP(EA), eV:	-9.07(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[(2-methoxyphenyl)methyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=CC(=CC=C2)Cl

DOS

IR

Vibrations