Geometry & MOs

Info

ID:	236867
PubChem CID:	92715181
Reduced:	ClN3O4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	370.131742
ΔH_f, kcal/mol:	-176.14
Dipole, Da:	6.57
IP(EA), eV:	-9.41(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dioxo-2-phenyl-N-[(1R)-1-phenylethyl]isoindole-5-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)COC(=O)C[C@H](C2=CC=CC=C2Cl)NC(=O)N

DOS

IR

Vibrations