Geometry & MOs

Info

ID:	149075
PubChem CID:	53788746
Reduced:	SN3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	432.114378
ΔH_f, kcal/mol:	31.23
Dipole, Da:	6.24
IP(EA), eV:	-8.08(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-6-methyl-7-[2-(3-methylphenyl)ethenyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CC1N3C=C(NC3=S)CCN

DOS

IR

Vibrations