Geometry & MOs

Info

ID:	53073
PubChem CID:	14709517
Reduced:	O3N4C16H34 (1)
Stoich.:	A3B4C16D34 (1)
Weight, g/mol:	406.294391
ΔH_f, kcal/mol:	-118.26
Dipole, Da:	4.7
IP(EA), eV:	-8.38(1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

19,22,27-trioxa-1,4,13,16-tetrazatricyclo[14.8.5.06,11]nonacosa-6,8,10-triene

Drug info:

PubChemData

Smile

C1CNCCN2CCOCCN(CCN1)CCOCCOCC2

DOS

IR

Vibrations