Geometry & MOs

Info

ID:	189007
PubChem CID:	77802499
Reduced:	O4N5C23H23 (1)
Stoich.:	A4B5C23D23 (1)
Weight, g/mol:	466.231516
ΔH_f, kcal/mol:	-79.93
Dipole, Da:	12.06
IP(EA), eV:	-9.17(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-2-oxo-1,3-oxazolidine-4-carboxamide;2-(2-butoxy-1-hydroxy-2-oxoethyl)-4-methylpentanoic acid

Drug info:

PubChemData

Smile

CCC1(C2=C(COC1=O)C(=O)N3CC4=C(C5=CC=CC=C5N=C4C3=C2)C(C)N=C(N)N)O

DOS

IR

Vibrations