Geometry & MOs

Info

ID:	434351
PubChem CID:	135174733
Reduced:	O4C25H36 (1)
Stoich.:	A4B25C36 (1)
Weight, g/mol:	732.269633
ΔH_f, kcal/mol:	-156.64
Dipole, Da:	3.51
IP(EA), eV:	-8.43(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1,3-dioxo-5-[3-[3-[4-[4-(1-oxo-2,3-dihydroinden-5-yl)-3-pyridin-4-ylpyrazol-1-yl]phenoxy]azetidin-1-yl]azetidin-1-yl]inden-2-yl]piperidine-2,6-dione

Drug info:

PubChemData

Smile

CC(C)OCCCOCCOC1=CC=CC=C1COC2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations