Geometry & MOs

Info

ID:

188901

PubChem CID:

77781169

Reduced:

O5C31H52 (1)

Stoich.:

A5B31C52 (1)

Weight, g/mol:

512.117041

ΔHf, kcal/mol:

-320.65

Dipole, Da:

2.32

IP(EA), eV:

 -9.39(0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[10-[chloromethyl(dimethyl)silyl]-19-ethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] acetate

Drug info:

PubChemData

Smile

CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4O)C)OCCCCCCCCCCCC(=O)O

DOS

IR

Vibrations