Geometry & MOs

Info

ID:	48935
PubChem CID:	11528494
Reduced:	SC12H14 (1)
Stoich.:	AB12C14 (1)
Weight, g/mol:	191.1674
ΔH_f, kcal/mol:	0.4
Dipole, Da:	2.47
IP(EA), eV:	-8.54(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S,5S)-4,6,6-trimethyl-2-prop-2-enylbicyclo[3.1.1]hept-3-en-2-amine

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC3=C2CSC3

DOS

IR

Vibrations