Geometry & MOs

Info

ID:	50575
PubChem CID:	12013125
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	265.111422
ΔH_f, kcal/mol:	-59.31
Dipole, Da:	2.92
IP(EA), eV:	-10.01(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-butoxy-4,5-dihydro-1,2-oxazol-3-yl)-(4-fluorophenyl)methanone

Drug info:

PubChemData

Smile

CCCCOC1CC(=NO1)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations