Geometry & MOs

Info

ID:	187950
PubChem CID:	77647107
Reduced:	FN3O3C33H48 (1)
Stoich.:	AB3C3D33E48 (1)
Weight, g/mol:	609.281441
ΔH_f, kcal/mol:	-202.57
Dipole, Da:	7.75
IP(EA), eV:	-8.97(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-N-[3-hydroxy-1-phenyl-4-[[3-(trifluoromethoxy)phenyl]methylamino]butan-2-yl]-5-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

CCCC1=CC(=C(C(=C1)N2CCCC2=O)F)C(=O)NC(CC3=CC=CC=C3)C(CNC(C)(C)CCCC(C)C)O

DOS

IR

Vibrations