Geometry & MOs

Info

ID:	224533
PubChem CID:	85344567
Reduced:	NC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	190.172151
ΔH_f, kcal/mol:	35.79
Dipole, Da:	4.5
IP(EA), eV:	-8.62(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,6,8-trimethyltricyclo[5.3.1.01,5]undec-8-ene

Drug info:

PubChemData

Smile

CCC=CCCC=CC1=NC=CN1C

DOS

IR

Vibrations