Geometry & MOs

Info

ID:	224708
PubChem CID:	85346995
Reduced:	SN2O4C24H34 (1)
Stoich.:	AB2C4D24E34 (1)
Weight, g/mol:	446.412381
ΔH_f, kcal/mol:	-169.51
Dipole, Da:	8.06
IP(EA), eV:	-8.14(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(dec-9-enyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-diol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(=C2)C=CC3CCCCN3C(=O)OC(C)(C)C

DOS

IR

Vibrations