Geometry & MOs

Info

ID:	238332
PubChem CID:	92730012
Reduced:	SN3O4C25H33 (1)
Stoich.:	AB3C4D25E33 (1)
Weight, g/mol:	471.219178
ΔH_f, kcal/mol:	-162.93
Dipole, Da:	6.25
IP(EA), eV:	-8.96(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCC[C@H]3C(=O)NCCC(C)C)C

DOS

IR

Vibrations