Geometry & MOs

Info

ID:	195635
PubChem CID:	78712859
Reduced:	N2O5C24H24 (1)
Stoich.:	A2B5C24D24 (1)
Weight, g/mol:	398.1278
ΔH_f, kcal/mol:	-135.09
Dipole, Da:	4.83
IP(EA), eV:	-9.13(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(3-fluorophenyl)methyl-methylamino]-1-oxopropan-2-yl] 2-(1,3-dioxoisoindol-2-yl)acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC=C3C(=O)OCC(=O)NCC4CCCO4

DOS

IR

Vibrations