Geometry & MOs

Info

ID:	82659
PubChem CID:	49856296
Reduced:	OF2N5C22H23 (1)
Stoich.:	AB2C5D22E23 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	-59.59
Dipole, Da:	6.01
IP(EA), eV:	-8.77(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(1R,2R)-2-(1,3-dioxoisoindol-2-yl)cyclohexyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1(C2=NC(=C(N2CCN1C(=O)CN)NC3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C

DOS

IR

Vibrations