Geometry & MOs

Info

ID:	142861
PubChem CID:	53105084
Reduced:	SN3O4C23H23 (1)
Stoich.:	AB3C4D23E23 (1)
Weight, g/mol:	454.192629
ΔH_f, kcal/mol:	-80.98
Dipole, Da:	6.12
IP(EA), eV:	-9.18(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,6-trimethyl-N-(4-propan-2-ylphenyl)-2-(pyrrolidine-1-carbonyl)-1-benzofuran-7-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1C)S(=O)(=O)NC3=CC=CC(=C3)C#N)OC(=C2C)C(=O)N4CCCC4

DOS

IR

Vibrations