Geometry & MOs

Info

ID:	214256
PubChem CID:	84974795
Reduced:	N2O3C20H24 (1)
Stoich.:	A2B3C20D24 (1)
Weight, g/mol:	419.148121
ΔH_f, kcal/mol:	-56.1
Dipole, Da:	2.79
IP(EA), eV:	-8.2(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-oxopropan-2-yl] 3-(1,3-benzoxazol-2-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)CNC(=O)C=CC2=C(C(=CC=C2)OC)OC

DOS

IR

Vibrations