Geometry & MOs

Info

ID:	202252
PubChem CID:	79646352
Reduced:	N2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	329.07555
ΔH_f, kcal/mol:	-8.15
Dipole, Da:	1.88
IP(EA), eV:	-8.62(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(methylamino)-3-(4-methylsulfonylphenyl)sulfanylcyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)CN(C)CC(C)(C)CN

DOS

IR

Vibrations