Geometry & MOs

Info

ID:	424632
PubChem CID:	135123402
Reduced:	SO4N6C35H46 (1)
Stoich.:	AB4C6D35E46 (1)
Weight, g/mol:	421.090784
ΔH_f, kcal/mol:	-76.07
Dipole, Da:	2.98
IP(EA), eV:	-8.55(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5'-[(2,4-difluorophenyl)sulfonylamino]-2'-oxospiro[cyclopentane-1,3'-indole]-1'-carboxamide

Drug info:

PubChemData

Smile

CCCN1C=C(N=N1)CCC(C2=CC(=C(C=C2)C)CN3CC(OC4=CC=CC=C4S3(O)O)CC)C(C)(C)C(=O)NC5=CN=CC=C5

DOS

IR

Vibrations