Geometry & MOs

Info

ID:	65078
PubChem CID:	29204435
Reduced:	NO4C20H23 (1)
Stoich.:	AB4C20D23 (1)
Weight, g/mol:	338.163043
ΔH_f, kcal/mol:	-125.95
Dipole, Da:	5.36
IP(EA), eV:	-8.54(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-butylphenyl)-2-[(2R)-3-oxo-4H-1,4-benzoxazin-2-yl]acetamide

Drug info:

PubChemData

Smile

CCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(C(=C2)OC)OCCO3

DOS

IR

Vibrations