Geometry & MOs

Info

ID:	70145
PubChem CID:	47208138
Reduced:	N2F3O3H11C12 (1)
Stoich.:	A2B3C3D11E12 (1)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-256.03
Dipole, Da:	3.99
IP(EA), eV:	-9.14(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclobutylmethyl)-1H-quinazoline-2,4-dione

Drug info:

PubChemData

Smile

C1CN(C(=O)N1)C2=CC=CC(=C2)C(=O)OCC(F)(F)F

DOS

IR

Vibrations