Geometry & MOs

Info

ID:	21769
PubChem CID:	589860
Reduced:	N2O4C11H12 (1)
Stoich.:	A2B4C11D12 (1)
Weight, g/mol:	236.079707
ΔH_f, kcal/mol:	-159.16
Dipole, Da:	6.77
IP(EA), eV:	-9.86(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CC(CO)O

DOS

IR

Vibrations