Geometry & MOs

Info

ID:

164392

PubChem CID:

74393564

Reduced:

SiO5C23H38 (1)

Stoich.:

AB5C23D38 (1)

Weight, g/mol:

1626.749378

ΔHf, kcal/mol:

-276.54

Dipole, Da:

1.12

IP(EA), eV:

-8.76(0.26)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[4-[[6-amino-2-[[2-[[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-[[[4-[(2,5-dioxopyrrol-1-yl)methyl]cyclohexanecarbonyl]amino]methyl]triazol-1-yl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethoxy]acetyl]amino]-3-phenylpropanoyl]amino]hexanoyl]amino]phenyl]methyl (10,19-diethyl-7-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-19-yl) carbonate

Drug info:

PubChemData

Smile

CC(CC(CC=C)O[Si](C)(C)C(C)(C)C)OC(=O)CC1=CC(=CC(=C1)OC)OC

DOS

IR

Vibrations