Geometry & MOs

Info

ID:	213526
PubChem CID:	81064053
Reduced:	ClNSO4C14H22 (1)
Stoich.:	ABCD4E14F22 (1)
Weight, g/mol:	204.183778
ΔH_f, kcal/mol:	-163.36
Dipole, Da:	4.83
IP(EA), eV:	-9.31(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-ethoxyethyl(methyl)amino]-2-(ethylamino)propan-1-ol

Drug info:

PubChemData

Smile

CC(C)OCCN(C)S(=O)(=O)C1=CC=C(C=C1)OCCCl

DOS

IR

Vibrations