Geometry & MOs

Info

ID:

223693

PubChem CID:

85335430

Reduced:

NSiO2C31H45 (1)

Stoich.:

ABC2D31E45 (1)

Weight, g/mol:

492.248504

ΔHf, kcal/mol:

-128.66

Dipole, Da:

3.96

IP(EA), eV:

 -8.32(0.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

11-[(2-acetamido-3-methylpentanoyl)amino]-12-oxo-N-(pyridazin-4-ylmethyl)-1-azatricyclo[6.4.1.04,13]trideca-4,6,8(13)-triene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCC3CCCC34CCCC5N4CC(CC5)CO

DOS

IR

Vibrations