Geometry & MOs

Info

ID:	55876
PubChem CID:	17396873
Reduced:	N3O3C20H23 (1)
Stoich.:	A3B3C20D23 (1)
Weight, g/mol:	366.121572
ΔH_f, kcal/mol:	-71.78
Dipole, Da:	3.86
IP(EA), eV:	-8.72(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2,3-dimethylbenzoyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC3=CC=CC=C3C(=O)N

DOS

IR

Vibrations