Geometry & MOs

Info

ID:	203536
PubChem CID:	79842827
Reduced:	SN2O3C13H22 (1)
Stoich.:	AB2C3D13E22 (1)
Weight, g/mol:	314.166414
ΔH_f, kcal/mol:	-111.57
Dipole, Da:	5.7
IP(EA), eV:	-8.06(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(ethylaminomethyl)phenoxy]-N-methyl-N-(2-methylsulfonylethyl)ethanamine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)N)CN(C)CCS(=O)(=O)C

DOS

IR

Vibrations