Geometry & MOs

Info

ID:	273955
PubChem CID:	103806080
Reduced:	BrClON2C14H18 (1)
Stoich.:	ABCD2E14F18 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-48.35
Dipole, Da:	4.46
IP(EA), eV:	-8.89(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-aminocyclohexyl)quinoxaline-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1CCCNC1)NC(=O)C2=C(C=CC(=C2)Cl)Br

DOS

IR

Vibrations