Geometry & MOs

Info

ID:	244720
PubChem CID:	99381167
Reduced:	S2N3O5C17H25 (1)
Stoich.:	A2B3C5D17E25 (1)
Weight, g/mol:	400.196234
ΔH_f, kcal/mol:	-190.48
Dipole, Da:	13.46
IP(EA), eV:	-9.37(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(1R)-1,2-bis(3-fluorophenyl)ethyl]amino]-2-oxoethyl]-2-cyclopentylacetamide

Drug info:

PubChemData

Smile

C1CN(S(=O)(=O)C1)CCNC(=O)C2=CC=CC(=C2)CN3CCS(=O)(=O)CC3

DOS

IR

Vibrations