Geometry & MOs

Info

ID:	317620
PubChem CID:	126644355
Reduced:	O3N8C36H46 (1)
Stoich.:	A3B8C36D46 (1)
Weight, g/mol:	371.103669
ΔH_f, kcal/mol:	-15.17
Dipole, Da:	3.0
IP(EA), eV:	-8.54(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)C2=CC=C(C=C2)CO[C@H]3CN(C[C@@H]3NC(=O)C4=C(N=CC(=C4)C5=CN(N=C5)C)N)C)N6CCN(CC6)CCO

DOS

IR

Vibrations