Geometry & MOs

Info

ID:	380399
PubChem CID:	134970840
Reduced:	OPH23C34 (1)
Stoich.:	ABC23D34 (1)
Weight, g/mol:	485.08518
ΔH_f, kcal/mol:	101.01
Dipole, Da:	1.63
IP(EA), eV:	-8.21(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-1-(4-iodophenyl)-3,4-bis(phenylmethoxy)pyrrolidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OP(C2=C3C=CC=CC3=CC4=CC=CC=C42)C5=C6C=CC=CC6=CC7=CC=CC=C75

DOS

IR

Vibrations