Geometry & MOs

Info

ID:	380936
PubChem CID:	134971540
Reduced:	NC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	258.234751
ΔH_f, kcal/mol:	119.79
Dipole, Da:	6.14
IP(EA), eV:	-7.17(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4aS,4bR,8aR)-1,4a,7,8a-tetramethyl-8-methylidene-2,3,4,4b,5,9,10,10a-octahydro-1H-phenanthrene

Drug info:

PubChemData

Smile

C[C@H](C[C@H](C1=C([CH-]C=C1)N)N(C)C)C2=C[CH-]C=C2

DOS

IR

Vibrations