Geometry & MOs

Info

ID:	120781
PubChem CID:	50744174
Reduced:	ClN2O4H13C16 (1)
Stoich.:	AB2C4D13E16 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-107.42
Dipole, Da:	6.15
IP(EA), eV:	-8.85(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-2-oxo-1,3-benzoxazol-6-yl)-2-(3-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl)OC1=O

DOS

IR

Vibrations