Geometry & MOs

Info

ID:	129395
PubChem CID:	51072481
Reduced:	FNOC12H16 (1)
Stoich.:	ABCD12E16 (1)
Weight, g/mol:	311.076219
ΔH_f, kcal/mol:	-94.33
Dipole, Da:	2.17
IP(EA), eV:	-9.77(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4,5-dimethyl-1,3-thiazol-2-yl)-7a-methyl-5-oxo-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazole-3-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)NC(C)C1=CC(=CC=C1)F

DOS

IR

Vibrations