Geometry & MOs

Info

ID:	383730
PubChem CID:	134975615
Reduced:	NC14H25 (1)
Stoich.:	AB14C25 (1)
Weight, g/mol:	224.141244
ΔH_f, kcal/mol:	-15.5
Dipole, Da:	1.7
IP(EA), eV:	-8.23(1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1S,4aS,8aR)-1-methyl-2-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate

Drug info:

PubChemData

Smile

CC(=CC[C@@H]1CCCN1CC=C(C)C)C

DOS

IR

Vibrations