Geometry & MOs

Info

ID:	151773
PubChem CID:	56310574
Reduced:	S2N3O5C21H27 (1)
Stoich.:	A2B3C5D21E27 (1)
Weight, g/mol:	404.176979
ΔH_f, kcal/mol:	-119.08
Dipole, Da:	7.11
IP(EA), eV:	-7.99(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]-2,5-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

DOS

IR

Vibrations