Geometry & MOs

Info

ID:	188496
PubChem CID:	77724080
Reduced:	ClN4O9C26H43 (1)
Stoich.:	AB4C9D26E43 (1)
Weight, g/mol:	387.114044
ΔH_f, kcal/mol:	-472.23
Dipole, Da:	8.82
IP(EA), eV:	-9.52(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-benzothiophen-5-yloxy)-4-phenylbutan-2-amine;oxalic acid

Drug info:

PubChemData

Smile

CCCC(C(=O)NC(CC(C)C)C(=O)NC(CO)C(C(C(C(=O)NC(CC(=O)O)C1=CC=CC=C1)O)O)O)N.Cl

DOS

IR

Vibrations