Geometry & MOs

Info

ID:	152998
PubChem CID:	56312107
Reduced:	SN3O3C22H25 (1)
Stoich.:	AB3C3D22E25 (1)
Weight, g/mol:	429.135842
ΔH_f, kcal/mol:	-45.81
Dipole, Da:	7.15
IP(EA), eV:	-7.72(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-2-methyl-1,3-dioxoisoindole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=CC=C2)S(=O)(=O)NCC3CCN(C3)C4=CC=CC=C4OC)N=C1

DOS

IR

Vibrations