Geometry & MOs

Info

ID:	50228
PubChem CID:	12012740
Reduced:	N3O6H17C21 (1)
Stoich.:	A3B6C17D21 (1)
Weight, g/mol:	379.116821
ΔH_f, kcal/mol:	-157.76
Dipole, Da:	3.81
IP(EA), eV:	-9.15(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-acetyl-1'-methyl-2'-oxospiro[1,3,4-oxadiazole-5,3'-indole]-2-yl)phenyl] acetate

Drug info:

PubChemData

Smile

CC(=O)N1C2=CC=CC=C2C3(C1=O)N(N=C(O3)C4=CC=CC=C4OC(=O)C)C(=O)C

DOS

IR

Vibrations