Geometry & MOs

Info

ID:

168513

PubChem CID:

74981569

Reduced:

O3N4C34H46 (1)

Stoich.:

A3B4C34D46 (1)

Weight, g/mol:

404.236288

ΔHf, kcal/mol:

-153.59

Dipole, Da:

6.86

IP(EA), eV:

 -8.55(-0.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(16-fluoro-10,13-dimethyl-7,17-dioxo-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl) 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1CC(C(=O)N2C1(C3=C(CC2)C4=CC=CC=C4N3)C)CC(=O)NCC56CC7CC(C5)CC(C7)C6

DOS

IR

Vibrations