Geometry & MOs

Info

ID:	31529
PubChem CID:	855829
Reduced:	SN2O2H14C15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	290.028062
ΔH_f, kcal/mol:	-5.58
Dipole, Da:	4.56
IP(EA), eV:	-8.74(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-chlorophenoxy)-5,6-dimethylthieno[2,3-d]pyrimidine

Drug info:

PubChemData

Smile

CC1=C(SC2=NC=NC(=C12)OC3=CC=C(C=C3)OC)C

DOS

IR

Vibrations