Geometry & MOs

Info

ID:	424580
PubChem CID:	135123213
Reduced:	SN5O6C26H33 (1)
Stoich.:	AB5C6D26E33 (1)
Weight, g/mol:	484.214427
ΔH_f, kcal/mol:	-151.45
Dipole, Da:	7.42
IP(EA), eV:	-9.07(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[7-[(1-methylpiperidin-3-yl)amino]-2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC[C@@H]1CN(S(=O)(=O)C2=C(O1)C=CC=N2)CC3=C(C=CC(=C3)C(C(C)(C)C(=O)O)OCC4=CN(N=N4)C)C

DOS

IR

Vibrations