Geometry & MOs

Info

ID:	438489
PubChem CID:	135228231
Reduced:	N2C11H26 (1)
Stoich.:	A2B11C26 (1)
Weight, g/mol:	433.111022
ΔH_f, kcal/mol:	-45.12
Dipole, Da:	2.95
IP(EA), eV:	-8.77(3.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[9-(methoxymethyl)-15-(trifluoromethoxy)-2,4,8,10,11-pentazatetracyclo[11.4.0.02,6.08,12]heptadeca-1(13),3,5,9,11,14,16-heptaen-5-yl]-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)(CCC(C)(C)NC)CCN

DOS

IR

Vibrations