Geometry & MOs

Info

ID:

162102

PubChem CID:

57393625

Reduced:

OC4H4 (5)

Stoich.:

AB4C4 (5)

Weight, g/mol:

1004.548374

ΔHf, kcal/mol:

-126.03

Dipole, Da:

4.74

IP(EA), eV:

-8.85(-0.66)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-5-[2-[2-[2-[2-[3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butylcarbamoyl]pyrazolo[1,5-a]pyridin-5-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]pyrazolo[1,5-a]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)/C=C/C(=O)C2=C(C=C(C=C2)OCC=C)O)OC

DOS

IR

Vibrations