Geometry & MOs

Info

ID:	159412
PubChem CID:	57280038
Reduced:	NO5C25H43 (1)
Stoich.:	AB5C25D43 (1)
Weight, g/mol:	164.058578
ΔH_f, kcal/mol:	-273.6
Dipole, Da:	4.67
IP(EA), eV:	-9.24(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-diazenylphenyl) acetate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(N)OC(=O)C1=CC(=C(C(=C1)O)O)O

DOS

IR

Vibrations