Geometry & MOs

Info

ID:	424926
PubChem CID:	135124464
Reduced:	S2O4N6C35H40 (1)
Stoich.:	A2B4C6D35E40 (1)
Weight, g/mol:	383.130363
ΔH_f, kcal/mol:	-38.44
Dipole, Da:	9.07
IP(EA), eV:	-9.11(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(7-cyclopropyl-2-oxospiro[1H-indole-3,1'-cyclopentane]-5-yl)pyridine-2-sulfonamide

Drug info:

PubChemData

Smile

CC[C@@H]1CN(S(=O)(=O)C2=CC=CC=C2O1)CC3=C(SC(=C3)C(C4=C(C5=C(C=C4)N(N=N5)CC)C)C(C)(C)C(=O)NC6=CN=CC=C6)C

DOS

IR

Vibrations