Geometry & MOs

Info

ID:	193589
PubChem CID:	78409765
Reduced:	NO6C20H27 (1)
Stoich.:	AB6C20D27 (1)
Weight, g/mol:	264.162649
ΔH_f, kcal/mol:	-196.25
Dipole, Da:	17.39
IP(EA), eV:	-8.8(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-ethylidene-12-methylidene-1,8-diazatetracyclo[11.2.2.03,11.05,9]heptadeca-3(11),4,6,9-tetraene

Drug info:

PubChemData

Smile

CCCOC(=O)C1(CC1C[NH+](C)C)C2=CC=CC=C2.C(=CC(=O)[O-])C(=O)O

DOS

IR

Vibrations