Geometry & MOs

Info

ID:	23008
PubChem CID:	600872
Reduced:	O2C21H34 (1)
Stoich.:	A2B21C34 (1)
Weight, g/mol:	318.25588
ΔH_f, kcal/mol:	-140.28
Dipole, Da:	1.92
IP(EA), eV:	-9.29(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CCC2C3(CCCC(C3CCC2(C1C(=O)OC)C)(C)C)C

DOS

IR

Vibrations