Geometry & MOs

Info

ID:	385631
PubChem CID:	134979586
Reduced:	C2H3 (6)
Stoich.:	A2B3 (6)
Weight, g/mol:	284.214016
ΔH_f, kcal/mol:	-12.81
Dipole, Da:	0.46
IP(EA), eV:	-8.83(1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aR)-8-methoxy-1,4a-dimethyl-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthrene

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H]2C1=C3CCCC3C2

DOS

IR

Vibrations