Geometry & MOs

Info

ID:	302760
PubChem CID:	124394685
Reduced:	ClSO2N5C24H28 (1)
Stoich.:	ABC2D5E24F28 (1)
Weight, g/mol:	450.161329
ΔH_f, kcal/mol:	-25.55
Dipole, Da:	6.19
IP(EA), eV:	-8.59(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (5S)-5-[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Drug info:

PubChemData

Smile

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(C)C)[C@H](C)NC(=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations