Geometry & MOs

Info

ID:	122092
PubChem CID:	50793955
Reduced:	FON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	435.123049
ΔH_f, kcal/mol:	-2.26
Dipole, Da:	5.57
IP(EA), eV:	-8.98(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 3-[(3-fluorobenzoyl)amino]-4-methylbenzoate

Drug info:

PubChemData

Smile

C1CCN(C1)CCCNC2=NC(=NO2)C3=CC=CC=C3F

DOS

IR

Vibrations