Geometry & MOs

Info

ID:	338329
PubChem CID:	127259021
Reduced:	O3C19H22 (1)
Stoich.:	A3B19C22 (1)
Weight, g/mol:	178.074228
ΔH_f, kcal/mol:	-103.42
Dipole, Da:	2.29
IP(EA), eV:	-8.53(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-(phenylhydrazinylidene)methyl] acetate

Drug info:

PubChemData

Smile

CCCCCOC1=C(C=CC(=C1)OC(=O)C)C2=CC=CC=C2

DOS

IR

Vibrations