Geometry & MOs

Info

ID:	157076
PubChem CID:	56422095
Reduced:	O4N5C20H25 (1)
Stoich.:	A4B5C20D25 (1)
Weight, g/mol:	420.14337
ΔH_f, kcal/mol:	-112.37
Dipole, Da:	5.17
IP(EA), eV:	-9.28(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-dioxoisoindol-2-yl)propyl 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

CC(C)C(C)(C#N)NC(=O)C(C)OC(=O)CCNC(=O)C1=NNC2=CC=CC=C21

DOS

IR

Vibrations