Geometry & MOs

Info

ID:	245370
PubChem CID:	99443956
Reduced:	F2N3O3C23H23 (1)
Stoich.:	A2B3C3D23E23 (1)
Weight, g/mol:	442.169271
ΔH_f, kcal/mol:	-157.78
Dipole, Da:	1.86
IP(EA), eV:	-9.74(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[(1S)-1-(2-fluorophenyl)ethyl]-2-(2-methylphenyl)-1,3-dioxoisoindole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1F)N(C2CC2)C(=O)CN3C(=O)[C@@](NC3=O)(C)C4=CC=C(C=C4)F

DOS

IR

Vibrations