Geometry & MOs

Info

ID:	28349
PubChem CID:	827140
Reduced:	N2O2C21H28 (1)
Stoich.:	A2B2C21D28 (1)
Weight, g/mol:	257.123821
ΔH_f, kcal/mol:	-24.73
Dipole, Da:	4.94
IP(EA), eV:	-8.27(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-(2-phenylsulfanylphenyl)ethanamine

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC[C@@H](C2=CC=CC=C2)OC3=CC=CC=C3OC

DOS

IR

Vibrations