Geometry & MOs

Info

ID:	223460
PubChem CID:	85335074
Reduced:	O5C22H28 (1)
Stoich.:	A5B22C28 (1)
Weight, g/mol:	372.23006
ΔH_f, kcal/mol:	-203.61
Dipole, Da:	3.34
IP(EA), eV:	-9.18(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 10,13-dimethyl-7,17-dioxo-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CC2=CC(=CC=C2)C3C(C(C(C(O3)CO)O)O)O

DOS

IR

Vibrations