Geometry & MOs

Info

ID:	245409
PubChem CID:	99444421
Reduced:	N2S2O5C18H24 (1)
Stoich.:	A2B2C5D18E24 (1)
Weight, g/mol:	423.125277
ΔH_f, kcal/mol:	-154.21
Dipole, Da:	3.26
IP(EA), eV:	-8.76(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(furan-2-yl)-N-[2-(3-methoxyphenoxy)ethyl]-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC(=O)NCCOC1=CC=CC(=C1)OC)S(=O)(=O)C2=CC=CS2

DOS

IR

Vibrations