Geometry & MOs

Info

ID:	249819
PubChem CID:	103092290
Reduced:	BrNSC16H18 (1)
Stoich.:	ABCD16E18 (1)
Weight, g/mol:	226.146999
ΔH_f, kcal/mol:	51.16
Dipole, Da:	3.0
IP(EA), eV:	-8.93(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-ethyl-4-quinolin-6-ylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C=C/C1=CC=C(S1)C2=CC(=CC=C2)Br

DOS

IR

Vibrations