Geometry & MOs

Info

ID:	28400
PubChem CID:	827369
Reduced:	ClN4H11C13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	273.118735
ΔH_f, kcal/mol:	99.61
Dipole, Da:	2.92
IP(EA), eV:	-9.01(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=NN2CNC3=CC(=CC=C3)Cl

DOS

IR

Vibrations