Geometry & MOs

Info

ID:	273930
PubChem CID:	103805904
Reduced:	ClION2C14H16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	251.109233
ΔH_f, kcal/mol:	68.51
Dipole, Da:	4.37
IP(EA), eV:	-9.42(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8-azabicyclo[3.2.1]octan-3-yl)-2-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2)NC(=O)C3=C(C=CC(=C3)Cl)I

DOS

IR

Vibrations