Geometry & MOs

Info

ID:

219815

PubChem CID:

85164924

Reduced:

NO14C27H39 (1)

Stoich.:

AB14C27D39 (1)

Weight, g/mol:

601.391098

ΔHf, kcal/mol:

-657.44

Dipole, Da:

5.84

IP(EA), eV:

 -9.76(0.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[7-[3-(2-azidoethoxy)propyl]-3-(2-methoxyethoxymethoxy)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy-tert-butyl-dimethylsilane

Drug info:

PubChemData

Smile

CC(=O)NC1C(C2C(C1OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC4(O2)CCCCC4)O

DOS

IR

Vibrations