Geometry & MOs

Info

ID:	166464
PubChem CID:	74693407
Reduced:	NO2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	372.158626
ΔH_f, kcal/mol:	-165.38
Dipole, Da:	23.6
IP(EA), eV:	-8.57(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-(pyridine-4-carbonyl)-5-pyridin-3-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Drug info:

PubChemData

Smile

C1CCC(C(C1)[NH2+]CC(=O)NCC(=O)[O-])O

DOS

IR

Vibrations