Geometry & MOs

Info

ID:	380400
PubChem CID:	134970842
Reduced:	INO2C24H24 (1)
Stoich.:	ABC2D24E24 (1)
Weight, g/mol:	435.219829
ΔH_f, kcal/mol:	9.53
Dipole, Da:	5.15
IP(EA), eV:	-8.29(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3,4-bis(phenylmethoxy)-1-(2-phenylphenyl)pyrrolidine

Drug info:

PubChemData

Smile

C1[C@@H]([C@H](CN1C2=CC=C(C=C2)I)OCC3=CC=CC=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations