Geometry & MOs

Info

ID:	385757
PubChem CID:	134979908
Reduced:	O2C7H12 (1)
Stoich.:	A2B7C12 (1)
Weight, g/mol:	317.271865
ΔH_f, kcal/mol:	-60.66
Dipole, Da:	3.03
IP(EA), eV:	-7.85(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1R,6S)-6-(2,6-dimethylhept-5-enyl)-2-pyrrolidin-1-ylcyclohex-3-en-1-yl]ethanone

Drug info:

PubChemData

Smile

C/C(=C\OC)/C=C\OC

DOS

IR

Vibrations