Geometry & MOs

Info

ID:	233231
PubChem CID:	89449380
Reduced:	NC5H8 (2)
Stoich.:	AB5C8 (2)
Weight, g/mol:	568.16455
ΔH_f, kcal/mol:	34.8
Dipole, Da:	2.49
IP(EA), eV:	-10.02(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[14-[2-[2-(iodomethoxy)ethoxy]ethyl]-2,8,11,17-tetraoxa-5,14-diazabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl]methanol

Drug info:

PubChemData

Smile

CC(C)C1=NC(=C)N=C1C(C)C

DOS

IR

Vibrations