Geometry & MOs

Info

ID:	215500
PubChem CID:	85084827
Reduced:	N5O14C48H95 (1)
Stoich.:	A5B14C48D95 (1)
Weight, g/mol:	967.442146
ΔH_f, kcal/mol:	-735.21
Dipole, Da:	4.57
IP(EA), eV:	-8.86(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

copper;[4-(2-hydroxy-4-oxopent-2-en-3-yl)phenyl] 4-decoxybenzoate

Drug info:

PubChemData

Smile

CCCCCNCC1C(C(C(C(O1)OC2C(OC(C2O)OC3C(C(CC(C3OC4C(C(C(C(O4)CO)O)O)NCCCCC)NCCCCC)NCCCCC)O)CO)NCCCCC)O)O

DOS

IR

Vibrations