Geometry & MOs

Info

ID:	271085
PubChem CID:	103643085
Reduced:	SN2O2C15H24 (1)
Stoich.:	AB2C2D15E24 (1)
Weight, g/mol:	301.134779
ΔH_f, kcal/mol:	-70.5
Dipole, Da:	4.19
IP(EA), eV:	-8.95(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethoxy-2-methoxyphenyl)methyl]-2-ethylsulfonylethanamine

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNCC1=CC=CC=C1N2CCCC2

DOS

IR

Vibrations