Geometry & MOs

Info

ID:	339078
PubChem CID:	127260330
Reduced:	NO4C22H25 (1)
Stoich.:	AB4C22D25 (1)
Weight, g/mol:	425.256609
ΔH_f, kcal/mol:	-140.34
Dipole, Da:	11.04
IP(EA), eV:	-8.82(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(diethylamino)-2-hydroxybenzoyl]-2-ethylhexyl] benzoate

Drug info:

PubChemData

Smile

CCCN(C1CCCC1)C2=CC(=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O)O

DOS

IR

Vibrations