Geometry & MOs

Info

ID:	62568
PubChem CID:	26719880
Reduced:	SN3O3H15C18 (1)
Stoich.:	AB3C3D15E18 (1)
Weight, g/mol:	410.130028
ΔH_f, kcal/mol:	-35.57
Dipole, Da:	5.06
IP(EA), eV:	-8.71(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(4-methoxyphenyl)sulfonyl-N-naphthalen-2-ylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)N=C2N1C=C(C=C2)C(=O)NC3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations