Geometry & MOs

Info

ID:	392838
PubChem CID:	135018146
Reduced:	SO17C32H40 (1)
Stoich.:	AB17C32D40 (1)
Weight, g/mol:	387.162314
ΔH_f, kcal/mol:	-745.6
Dipole, Da:	2.72
IP(EA), eV:	-8.77(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzhydrylidene-N-benzyl-2-benzofuran-1-imine

Drug info:

PubChemData

Smile

CC(=O)OCC1[C@H](C(C([C@@H](O1)SC2=CC=CC=C2)OC(=O)C)OC(=O)C)O[C@H]3C(C([C@H](C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations