Geometry & MOs

Info

ID:	357218
PubChem CID:	127293722
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	361.182398
ΔH_f, kcal/mol:	-216.47
Dipole, Da:	8.63
IP(EA), eV:	-9.26(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-(2-azabicyclo[2.2.1]heptan-2-yl)-2-oxoethyl]cyclohexyl]-N-(1,3-thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1(CC2=C(C=C(C(=O)N2)C(=O)NCC3COCCO3)C(=O)C1)C

DOS

IR

Vibrations