Geometry & MOs

Info

ID:	191714
PubChem CID:	78180255
Reduced:	ClO2N4C15H27 (1)
Stoich.:	AB2C4D15E27 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	-144.75
Dipole, Da:	5.89
IP(EA), eV:	-9.16(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-11-oxo-N-pyridin-2-yl-8-oxa-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene-12-carboxamide

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)CCCCCCC2=NCCCN2.Cl

DOS

IR

Vibrations