Geometry & MOs

Info

ID:	238331
PubChem CID:	92730011
Reduced:	SN3O4C27H35 (1)
Stoich.:	AB3C4D27E35 (1)
Weight, g/mol:	471.219178
ΔH_f, kcal/mol:	-157.98
Dipole, Da:	3.49
IP(EA), eV:	-8.94(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[4-[(2,4-dimethylphenyl)sulfonylamino]benzoyl]-N-(3-methylbutyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)[C@H]1CCCN1C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(CCCC4)C=C3

DOS

IR

Vibrations