Geometry & MOs

Info

ID:	343088
PubChem CID:	127266261
Reduced:	SO2N3C18H27 (1)
Stoich.:	AB2C3D18E27 (1)
Weight, g/mol:	335.130363
ΔH_f, kcal/mol:	-15.13
Dipole, Da:	4.02
IP(EA), eV:	-8.46(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-2-hydroxy-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]cyclopentane-1-sulfonamide

Drug info:

PubChemData

Smile

CCN(C1=CC=CC(=C1)C#C)S(=O)(=O)CCCN2CCN(CC2)C

DOS

IR

Vibrations