Geometry & MOs

Info

ID:	220044
PubChem CID:	85165180
Reduced:	NO3H37C45 (1)
Stoich.:	AB3C37D45 (1)
Weight, g/mol:	639.277344
ΔH_f, kcal/mol:	49.93
Dipole, Da:	2.25
IP(EA), eV:	-8.8(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-benzyl-1-(9-phenylfluoren-9-yl)-4-phenylmethoxy-2,5-dihydropyrrole-2-carboxylate

Drug info:

PubChemData

Smile

C1C(=O)C(C(N1C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC=CC=C5)C(=O)OCC6=CC=CC=C6)(CC7=CC=CC=C7)CC8=CC=CC=C8

DOS

IR

Vibrations