Geometry & MOs

Info

ID:	255587
PubChem CID:	103133155
Reduced:	ON3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	205.121512
ΔH_f, kcal/mol:	-5.55
Dipole, Da:	4.32
IP(EA), eV:	-9.36(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-azabicyclo[2.2.1]heptan-2-yl-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)CCCCN

DOS

IR

Vibrations