Geometry & MOs

Info

ID:	50578
PubChem CID:	12013128
Reduced:	ClNO3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	301.027249
ΔH_f, kcal/mol:	-69.53
Dipole, Da:	3.41
IP(EA), eV:	-9.96(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4-dichlorophenyl)-(5-ethoxy-4-methyl-4,5-dihydro-1,2-oxazol-3-yl)methanone

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations