Geometry & MOs

Info

ID:	379920
PubChem CID:	134964219
Reduced:	N2O3C13H14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	225.172879
ΔH_f, kcal/mol:	-10.73
Dipole, Da:	6.16
IP(EA), eV:	-9.22(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S,2R)-2-(hydroxymethyl)-2-methylcyclobutyl]-1-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

C1=CNC(=C1)C(CCO)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations