Geometry & MOs

Info

ID:	58635
PubChem CID:	24712363
Reduced:	FN2O3H17C18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	303.138305
ΔH_f, kcal/mol:	-58.97
Dipole, Da:	3.46
IP(EA), eV:	-8.72(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-fluorophenyl)-1-methyl-6-propan-2-yl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione

Drug info:

PubChemData

Smile

C1C(ON=C1C2=CC3=C(C=C2)OCO3)CNCC4=CC=CC=C4F

DOS

IR

Vibrations