Geometry & MOs

Info

ID:	142341
PubChem CID:	53019423
Reduced:	BrSO2N3H14C16 (1)
Stoich.:	ABC2D3E14F16 (1)
Weight, g/mol:	327.104148
ΔH_f, kcal/mol:	-25.51
Dipole, Da:	3.24
IP(EA), eV:	-8.75(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)-3-methylbenzamide

Drug info:

PubChemData

Smile

CCC1=CSC2=NC(=C(C(=O)N12)NC(=O)C3=CC=CC=C3Br)C

DOS

IR

Vibrations