Geometry & MOs

Info

ID:

221777

PubChem CID:

85286133

Reduced:

ClN3O6C34H38 (1)

Stoich.:

AB3C6D34E38 (1)

Weight, g/mol:

622.302954

ΔHf, kcal/mol:

-236.43

Dipole, Da:

3.51

IP(EA), eV:

 -8.49(-0.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] phenyltellanylformate

Drug info:

PubChemData

Smile

CC(CC1=CNC2=CC=CC=C21)(C(=O)N3CC(CC3C(=O)O)OC4=CC=C(C=C4)Cl)NC(=O)OC5C6CC7CC(C6)CC5C7

DOS

IR

Vibrations