Geometry & MOs

Info

ID:	28004
PubChem CID:	824783
Reduced:	NOH8C9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	275.105862
ΔH_f, kcal/mol:	17.31
Dipole, Da:	2.59
IP(EA), eV:	-9.04(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methoxyphenyl)-5,6-dihydrocyclopenta[b]pyridine-7,7-dicarbonitrile

Drug info:

PubChemData

Smile

CCOC1=NC(=NC=C1OC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations