Geometry & MOs

Info

ID:

434308

PubChem CID:

135174666

Reduced:

NO3C17H22 (2)

Stoich.:

AB3C17D22 (2)

Weight, g/mol:

680.13828

ΔHf, kcal/mol:

-174.13

Dipole, Da:

8.15

IP(EA), eV:

 -8.74(-1.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[5-[3-[3-[4-(4-bromo-3-pyridin-4-ylpyrazol-1-yl)phenoxy]azetidin-1-yl]azetidin-1-yl]-1,3-dioxoinden-2-yl]piperidine-2,6-dione

Drug info:

PubChemData

Smile

CC(C)C(=O)C1=CC2=C(O1)C=CC(=C2)OCCCNC(C)CCCC(=O)C3=CC4=C(O3)C=CC(=C4)OCCNC(C)C

DOS

IR

Vibrations