Geometry & MOs

Info

ID:	249862
PubChem CID:	103092555
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-40.58
Dipole, Da:	2.9
IP(EA), eV:	-8.48(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-ethoxy-3-methoxyphenyl)-N-ethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCCCOC1=CC=C(C=C1)/C=C/C(C)NCC

DOS

IR

Vibrations