Geometry & MOs

Info

ID:	121431
PubChem CID:	50767859
Reduced:	FSN3O4C25H30 (1)
Stoich.:	ABC3D4E25F30 (1)
Weight, g/mol:	499.214092
ΔH_f, kcal/mol:	-198.39
Dipole, Da:	2.86
IP(EA), eV:	-8.91(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,3-dimethyl-5-(3-methylpiperidin-1-yl)sulfonyl-2-oxoindol-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3(C)C)CC(=O)NC4=C(C=C(C=C4)F)C

DOS

IR

Vibrations