Geometry & MOs

Info

ID:	212192
PubChem CID:	81059793
Reduced:	NS2O5C10H15 (1)
Stoich.:	AB2C5D10E15 (1)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-175.8
Dipole, Da:	5.71
IP(EA), eV:	-9.94(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethoxyphenyl)-N-(2-ethoxyethyl)-N-methylethane-1,2-diamine

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC(=CS1)C(=O)O

DOS

IR

Vibrations