Geometry & MOs

Info

ID:	17107
PubChem CID:	484448
Reduced:	O3C22H30 (1)
Stoich.:	A3B22C30 (1)
Weight, g/mol:	342.219495
ΔH_f, kcal/mol:	-121.67
Dipole, Da:	2.32
IP(EA), eV:	-9.02(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1aR,1bS,5aS,9bS)-2,2,5a-trimethyl-9-propan-2-yl-1a,1b,3,4,5,9b-hexahydrophenanthro[9,10-b]oxiren-8-yl] acetate

Drug info:

PubChemData

Smile

CC(C)C1=C(C=CC2=C1[C@H]3[C@H](O3)[C@@H]4[C@@]2(CCCC4(C)C)C)OC(=O)C

DOS

IR

Vibrations