Geometry & MOs

Info

ID:	362755
PubChem CID:	127309301
Reduced:	O2N6C19H34 (1)
Stoich.:	A2B6C19D34 (1)
Weight, g/mol:	337.236542
ΔH_f, kcal/mol:	-47.83
Dipole, Da:	5.28
IP(EA), eV:	-8.7(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[1-(3-methylbutanoyl)piperidin-4-yl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)CNC(=O)N2CCN(CC2)C(C)C3=NC(=NO3)C

DOS

IR

Vibrations