Geometry & MOs

Info

ID:	43855
PubChem CID:	10321890
Reduced:	ClFO2N3C25H29 (1)
Stoich.:	ABC2D3E25F29 (1)
Weight, g/mol:	457.14382
ΔH_f, kcal/mol:	-76.84
Dipole, Da:	4.87
IP(EA), eV:	-8.9(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)-N-[(3S)-1-[(2S)-1-morpholin-4-yl-1-oxobutan-2-yl]-2-oxopyrrolidin-3-yl]ethanesulfonamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=C(C=C2)F)C(=O)/C=C/C3=C(C=C(C=C3)Cl)CN4CCOCC4

DOS

IR

Vibrations