Geometry & MOs

Info

ID:	31528
PubChem CID:	855828
Reduced:	NOC10H12 (2)
Stoich.:	ABC10D12 (2)
Weight, g/mol:	286.077599
ΔH_f, kcal/mol:	-74.63
Dipole, Da:	4.37
IP(EA), eV:	-8.52(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)NC(=O)C

DOS

IR

Vibrations