Geometry & MOs

Info

ID:	275252
PubChem CID:	103814837
Reduced:	OSN3C11H17 (1)
Stoich.:	ABC3D11E17 (1)
Weight, g/mol:	279.140533
ΔH_f, kcal/mol:	-11.9
Dipole, Da:	5.6
IP(EA), eV:	-9.27(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]bicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)CC2CNC2

DOS

IR

Vibrations