Geometry & MOs

Info

ID:	238330
PubChem CID:	92730010
Reduced:	SN3O4C27H35 (1)
Stoich.:	AB3C4D27E35 (1)
Weight, g/mol:	497.234828
ΔH_f, kcal/mol:	-161.58
Dipole, Da:	5.86
IP(EA), eV:	-8.92(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3-methylbutyl)-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]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