Geometry & MOs

Info

ID:	131116
PubChem CID:	51157788
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	331.124215
ΔH_f, kcal/mol:	-71.82
Dipole, Da:	5.16
IP(EA), eV:	-8.38(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-N-(3-phenylsulfanylpropyl)benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CCC4=CC=CC=C43

DOS

IR

Vibrations