Geometry & MOs

Info

ID:	218710
PubChem CID:	85089845
Reduced:	N2O2C14H21 (2)
Stoich.:	A2B2C14D21 (2)
Weight, g/mol:	498.355654
ΔH_f, kcal/mol:	-199.43
Dipole, Da:	5.05
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-hydroxy-5,5,11,11-tetramethyl-4,6,10,12-tetraoxatricyclo[7.3.0.03,7]dodecan-2-yl) hexadecanoate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(C)C1CCCCC1)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(C)C(=O)O

DOS

IR

Vibrations