Geometry & MOs

Info

ID:	424546
PubChem CID:	135123075
Reduced:	BrO2N3H26C29 (1)
Stoich.:	AB2C3D26E29 (1)
Weight, g/mol:	526.224991
ΔH_f, kcal/mol:	31.87
Dipole, Da:	2.89
IP(EA), eV:	-8.7(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-ethoxyphenyl)sulfonylamino]-N-(1-methylpiperidin-4-yl)-2-oxospiro[1H-indole-3,1'-cyclopentane]-7-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3Br)C4=CC=NN4C5=CC=CC=C5)C6(C2=O)CCCC6

DOS

IR

Vibrations