Geometry & MOs

Info

ID:	393627
PubChem CID:	135021311
Reduced:	N5O6C27H37 (1)
Stoich.:	A5B6C27D37 (1)
Weight, g/mol:	504.331171
ΔH_f, kcal/mol:	-130.16
Dipole, Da:	8.63
IP(EA), eV:	-8.38(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(dimethylamino)propylamino]-4-[12-[(2-ethoxy-3,4-dioxocyclobuten-1-yl)amino]dodecylamino]cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CN(C)CCCNC1=C(C(=O)C1=O)NCCCCCCNC2=C(C(=O)C2=O)NCCC3=CC(=C(C=C3)O)O

DOS

IR

Vibrations