Geometry & MOs

Info

ID:	405650
PubChem CID:	135074772
Reduced:	NSO4C15H21 (1)
Stoich.:	ABC4D15E21 (1)
Weight, g/mol:	272.250401
ΔH_f, kcal/mol:	-134.65
Dipole, Da:	6.24
IP(EA), eV:	-9.55(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,10R,14R)-5,5,9,13-tetramethyltetracyclo[8.6.0.01,14.04,9]hexadec-12-ene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC=O)C/C=C\CO

DOS

IR

Vibrations