Geometry & MOs

Info

ID:	376555
PubChem CID:	134222574
Reduced:	ClPN3O5C18H25 (1)
Stoich.:	ABC3D5E18F25 (1)
Weight, g/mol:	275.00581
ΔH_f, kcal/mol:	-250.95
Dipole, Da:	2.54
IP(EA), eV:	-9.07(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5,6-dihydrobenzo[f]quinoxalin-3-amine

Drug info:

PubChemData

Smile

CCOP(=O)(C(C(=O)OC(C)(C)C)NC1=NC2=CC=CC=C2N=C1Cl)OCC

DOS

IR

Vibrations