Geometry & MOs

Info

ID:	47938
PubChem CID:	10535898
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	196.14633
ΔH_f, kcal/mol:	-108.4
Dipole, Da:	2.28
IP(EA), eV:	-9.68(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl bicyclo[3.2.2]nonane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC[C@]12CC[C@H](C1)CCCC2=O

DOS

IR

Vibrations