Geometry & MOs

Info

ID:	402216
PubChem CID:	135054990
Reduced:	O2H20C21 (1)
Stoich.:	A2B20C21 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	-10.94
Dipole, Da:	2.23
IP(EA), eV:	-8.83(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(E)-hex-2-enoxy]ethenyl]aniline

Drug info:

PubChemData

Smile

COC(=O)/C=C/[C@H](C1C=CCC=C1)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations