Geometry & MOs

Info

ID:	38029
PubChem CID:	8026492
Reduced:	N2O3C21H24 (1)
Stoich.:	A2B3C21D24 (1)
Weight, g/mol:	344.083078
ΔH_f, kcal/mol:	-82.88
Dipole, Da:	1.94
IP(EA), eV:	-8.24(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[6-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-3-yl]acetate

Drug info:

PubChemData

Smile

CN(CC(=O)NC1=CC2=C(C=C1)OC3(O2)CCCCC3)C4=CC=CC=C4

DOS

IR

Vibrations