Geometry & MOs

Info

ID:	346304
PubChem CID:	127270808
Reduced:	FN3O5C18H20 (1)
Stoich.:	AB3C5D18E20 (1)
Weight, g/mol:	366.104956
ΔH_f, kcal/mol:	-236.51
Dipole, Da:	5.21
IP(EA), eV:	-9.25(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(C1)C(=O)N(C(=O)N2)CC(=O)NCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations