Geometry & MOs

Info

ID:

181218

PubChem CID:

76715977

Reduced:

FN3O5C41H42 (1)

Stoich.:

AB3C5D41E42 (1)

Weight, g/mol:

628.304304

ΔHf, kcal/mol:

-101.71

Dipole, Da:

4.16

IP(EA), eV:

 -8.86(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(dimethylsulfamoyl)-14-methyl-2,15-dioxo-18-(3-propan-2-ylimidazo[4,5-c]pyridin-2-yl)oxy-16-azatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC=CC2CC2(CC(=O)C3CC(CN3C(=O)C(CC1)CC4=CC(=CC=C4)F)OC5=NC=CC6=CC=CC=C65)C(=O)NOC7=CC=CC=C7

DOS

IR

Vibrations