Geometry & MOs

Info

ID:	153095
PubChem CID:	56312228
Reduced:	SN2F3O4C19H21 (1)
Stoich.:	AB2C3D4E19F21 (1)
Weight, g/mol:	432.183127
ΔH_f, kcal/mol:	-265.53
Dipole, Da:	2.88
IP(EA), eV:	-7.88(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CNS(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

DOS

IR

Vibrations