Geometry & MOs

Info

ID:	249975
PubChem CID:	103093237
Reduced:	NC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	239.1674
ΔH_f, kcal/mol:	25.51
Dipole, Da:	2.9
IP(EA), eV:	-8.99(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-ethyl-3-methyl-4-naphthalen-1-ylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C(=C/C1=CN=CC=C1)/C

DOS

IR

Vibrations