Geometry & MOs

Info

ID:	249850
PubChem CID:	103092511
Reduced:	BrNSC11H16 (1)
Stoich.:	ABCD11E16 (1)
Weight, g/mol:	227.142248
ΔH_f, kcal/mol:	19.12
Dipole, Da:	2.44
IP(EA), eV:	-8.99(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-ethyl-4-quinoxalin-2-ylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C=C/C1=CC(=C(S1)C)Br

DOS

IR

Vibrations