Geometry & MOs

Info

ID:	203692
PubChem CID:	79858982
Reduced:	SN2O3C7H16 (1)
Stoich.:	AB2C3D7E16 (1)
Weight, g/mol:	300.150764
ΔH_f, kcal/mol:	-138.92
Dipole, Da:	7.81
IP(EA), eV:	-9.53(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[3-(methylaminomethyl)phenoxy]-N-(2-methylsulfonylethyl)ethanamine

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N(C)CCS(=O)(=O)C)N

DOS

IR

Vibrations