Geometry & MOs

Info

ID:	219621
PubChem CID:	85154876
Reduced:	O9C28H34 (1)
Stoich.:	A9B28C34 (1)
Weight, g/mol:	514.275547
ΔH_f, kcal/mol:	-360.7
Dipole, Da:	5.37
IP(EA), eV:	-9.62(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-4-(3-fluoro-4-methylphenyl)-N-[1-[3-(3-methoxypropylamino)pyrrolidine-1-carbonyl]pyrrolidin-3-yl]-N-methylbenzamide

Drug info:

PubChemData

Smile

CCC1(C(C(C(O1)OC(=O)C)OCC2=CC=CC=C2)OCC3=CC=CC=C3)C(COC(=O)C)OC(=O)C

DOS

IR

Vibrations