Geometry & MOs

Info

ID:	249859
PubChem CID:	103092544
Reduced:	NC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	304.05751
ΔH_f, kcal/mol:	25.21
Dipole, Da:	2.82
IP(EA), eV:	-8.87(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(5-bromoquinolin-8-yl)-N-ethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C=C/C1=NC=C(C=C1)C

DOS

IR

Vibrations