Geometry & MOs

Info

ID:	281442
PubChem CID:	103913886
Reduced:	NS2O4C9H21 (1)
Stoich.:	AB2C4D9E21 (1)
Weight, g/mol:	245.119798
ΔH_f, kcal/mol:	-194.12
Dipole, Da:	3.12
IP(EA), eV:	-9.49(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylsulfonylethyl)-1-(1-methylimidazol-2-yl)ethanamine

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(C)CS(=O)(=O)CC

DOS

IR

Vibrations