Geometry & MOs

Info

ID:	49273
PubChem CID:	11532575
Reduced:	ClNS3O4H16C19 (1)
Stoich.:	ABC3D4E16F19 (1)
Weight, g/mol:	453.05757
ΔH_f, kcal/mol:	-110.44
Dipole, Da:	4.55
IP(EA), eV:	-9.16(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-7-ethyl-3,3-bis(4-hydroxyphenyl)-5-methoxy-1H-indol-2-one

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC=C(C=C3)C(=O)CSC(=O)C

DOS

IR

Vibrations