Geometry & MOs

Info

ID:	187461
PubChem CID:	77574314
Reduced:	O2N5C27H31 (1)
Stoich.:	A2B5C27D31 (1)
Weight, g/mol:	347.168543
ΔH_f, kcal/mol:	5.57
Dipole, Da:	2.61
IP(EA), eV:	-8.6(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[5-fluoro-2-(2-phenylphenyl)phenyl]methoxy]pyrrolidine

Drug info:

PubChemData

Smile

C1C(NC(N(C1=O)CCNCC2=CC3=C(C=C2)NC=C3)N)CCC4=CC(=CC=C4)C5=CC=CO5

DOS

IR

Vibrations