Geometry & MOs

Info

ID:	170546
PubChem CID:	75249497
Reduced:	BrNO7C25H28 (1)
Stoich.:	ABC7D25E28 (1)
Weight, g/mol:	438.289897
ΔH_f, kcal/mol:	-255.99
Dipole, Da:	5.25
IP(EA), eV:	-8.9(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraenyl phosphate

Drug info:

PubChemData

Smile

CC(C(=O)OC1CC2CCC(C1)N2C)OC3=CC4=C(C=C3)C=C(C=C4)Br.C(=CC(=O)O)C(=O)O

DOS

IR

Vibrations