Geometry & MOs

Info

ID:	329373
PubChem CID:	126735696
Reduced:	NSO2C15H23 (1)
Stoich.:	ABC2D15E23 (1)
Weight, g/mol:	279.1293
ΔH_f, kcal/mol:	-62.65
Dipole, Da:	7.4
IP(EA), eV:	-9.21(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethylsulfonylphenyl)-[(2S)-spiro[2.3]hexan-2-yl]methanamine

Drug info:

PubChemData

Smile

CCS(=O)(=O)C(=C)C12CCCC=C1CC(C(=C)C2)N

DOS

IR

Vibrations