Geometry & MOs

Info

ID:	55423
PubChem CID:	17395383
Reduced:	N3O3C17H19 (1)
Stoich.:	A3B3C17D19 (1)
Weight, g/mol:	327.121906
ΔH_f, kcal/mol:	-63.59
Dipole, Da:	6.17
IP(EA), eV:	-8.79(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CCN(CC1COC2=CC=CC=C2O1)C(=O)NC3=CN=CC=C3

DOS

IR

Vibrations