Geometry & MOs

Info

ID:	132164
PubChem CID:	51315161
Reduced:	ClFSO2N3H13C17 (1)
Stoich.:	ABCD2E3F13G17 (1)
Weight, g/mol:	379.055754
ΔH_f, kcal/mol:	-38.87
Dipole, Da:	4.41
IP(EA), eV:	-9.35(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

C1CC1N(CC2=C(C=CC=C2Cl)F)C(=O)C3=CN=C4N(C3=O)C=CS4

DOS

IR

Vibrations