Geometry & MOs

Info

ID:	163789
PubChem CID:	74380252
Reduced:	N3O5C14H15 (1)
Stoich.:	A3B5C14D15 (1)
Weight, g/mol:	495.119895
ΔH_f, kcal/mol:	-191.16
Dipole, Da:	5.18
IP(EA), eV:	-10.03(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[5-(3-fluorophenyl)-2-methyl-1,3-thiazole-4-carbonyl]-2-azabicyclo[3.1.0]hexan-3-yl]methyl]-6-methylimidazo[2,1-b][1,3]thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1C(NC(=O)NC1=O)C(=O)NC(CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations