Geometry & MOs

Info

ID:	362688
PubChem CID:	127309122
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	280.215078
ΔH_f, kcal/mol:	-72.0
Dipole, Da:	2.85
IP(EA), eV:	-9.39(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[(3-methylcyclohexyl)methyl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)CNC(=O)N2CCOC(C2)CN3C=CC=N3

DOS

IR

Vibrations