Geometry & MOs

Info

ID:	89344
PubChem CID:	49960595
Reduced:	NO3H7C8 (2)
Stoich.:	AB3C7D8 (2)
Weight, g/mol:	398.199428
ΔH_f, kcal/mol:	-175.12
Dipole, Da:	3.38
IP(EA), eV:	-9.15(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-1-[4-(3-phenylpropanoyl)-2,3-dihydroquinoxalin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

C1N(C2=CC=CC=C2N(C1)C(=O)/C=C/C(=O)O)C(=O)/C=C/C(=O)O

DOS

IR

Vibrations