Geometry & MOs

Info

ID:	15616
PubChem CID:	446146
Reduced:	SN3O5C19H35 (1)
Stoich.:	AB3C5D19E35 (1)
Weight, g/mol:	417.229742
ΔH_f, kcal/mol:	-263.3
Dipole, Da:	2.25
IP(EA), eV:	-8.35(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(2S,3R)-3-(methanesulfonamido)-1-(4-piperidin-1-ylbutanoyl)pyrrolidin-2-yl]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)[C@H]([C@H]1[C@@H](CCN1C(=O)CCCN2CCCCC2)NS(=O)(=O)C)C(=O)O

DOS

IR

Vibrations