Geometry & MOs

Info

ID:	28216
PubChem CID:	826341
Reduced:	ClOSH15C16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	273.118735
ΔH_f, kcal/mol:	-7.74
Dipole, Da:	2.74
IP(EA), eV:	-8.58(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methoxyphenyl)sulfanylphenyl]-N,N-dimethylmethanamine

Drug info:

PubChemData

Smile

CCO[C@@H]1CC2=C(C=CC(=C2)Cl)SC3=CC=CC=C13

DOS

IR

Vibrations