Geometry & MOs

Info

ID:	405218
PubChem CID:	135073053
Reduced:	O4C19H24 (1)
Stoich.:	A4B19C24 (1)
Weight, g/mol:	243.125929
ΔH_f, kcal/mol:	-161.9
Dipole, Da:	3.15
IP(EA), eV:	-8.6(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-[cyclohex-2-en-1-yl(phenyl)methylidene]amino] acetate

Drug info:

PubChemData

Smile

COC(=O)C(CCCC1=C(CCC1)C2=CC=CC=C2)C(=O)OC

DOS

IR

Vibrations