Geometry & MOs

Info

ID:	79498
PubChem CID:	49786850
Reduced:	NO4C21H23 (1)
Stoich.:	AB4C21D23 (1)
Weight, g/mol:	371.056233
ΔH_f, kcal/mol:	-110.91
Dipole, Da:	3.3
IP(EA), eV:	-8.75(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-fluorophenyl)methylamino]-3-methyl-6-thiophen-3-ylthieno[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)C2=COC3=C2C=CC=C3C(=O)NCCCOC

DOS

IR

Vibrations