Geometry & MOs

Info

ID:	169843
PubChem CID:	75156539
Reduced:	N3O3C36H43 (1)
Stoich.:	A3B3C36D43 (1)
Weight, g/mol:	477.145534
ΔH_f, kcal/mol:	-66.82
Dipole, Da:	4.75
IP(EA), eV:	-8.77(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

2-[4-[(4-chlorophenyl)methyl]-2,3-dioxoquinoxaline-1,4-diium-1-yl]-N-[2-(2-methoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCN(CCCNC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C3CCCCC3O2)CC4=CC=CC(=C4)C)CC5=CC=CC=C5

DOS

IR

Vibrations