Geometry & MOs

Info

ID:	33823
PubChem CID:	7888299
Reduced:	O2S2N4H16C17 (1)
Stoich.:	A2B2C4D16E17 (1)
Weight, g/mol:	396.071468
ΔH_f, kcal/mol:	3.68
Dipole, Da:	1.08
IP(EA), eV:	-8.99(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=N1)SCC(=O)NNC(=O)C

DOS

IR

Vibrations