Geometry & MOs

Info

ID:	221456
PubChem CID:	85273723
Reduced:	FN3O4C14H16 (1)
Stoich.:	AB3C4D14E16 (1)
Weight, g/mol:	309.111341
ΔH_f, kcal/mol:	-151.59
Dipole, Da:	2.11
IP(EA), eV:	-9.65(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(pyridin-4-ylmethylideneamino)oxypropyl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC1=NN(C(=N1)C2C(C(C(O2)CO)O)O)C3=CC=C(C=C3)F

DOS

IR

Vibrations