Geometry & MOs

Info

ID:	35208
PubChem CID:	7979493
Reduced:	N2F3O3H15C17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	388.145678
ΔH_f, kcal/mol:	-219.28
Dipole, Da:	5.46
IP(EA), eV:	-9.38(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(cyclopentylamino)-2-oxoethyl] (3R,7aR)-5-oxo-7a-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxylate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations