Geometry & MOs

Info

ID:	128668
PubChem CID:	51053752
Reduced:	OSN3F4H13C15 (1)
Stoich.:	ABC3D4E13F15 (1)
Weight, g/mol:	303.078996
ΔH_f, kcal/mol:	-174.12
Dipole, Da:	5.42
IP(EA), eV:	-9.0(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-imidazol-5-yl)ethyl]-3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(SCC(=O)N=C2N(N1)C)C3=C(C=CC(=C3)C(F)(F)F)F

DOS

IR

Vibrations