Geometry & MOs

Info

ID:	322465
PubChem CID:	126670214
Reduced:	O2N4C15H18 (2)
Stoich.:	A2B4C15D18 (2)
Weight, g/mol:	273.24565
ΔH_f, kcal/mol:	-27.16
Dipole, Da:	9.81
IP(EA), eV:	-8.13(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,3-dimethylpentan-2-yl)-2,4,6-trimethyl-3-methylidene-7,7a-dihydro-5H-cyclopenta[b]pyridine

Drug info:

PubChemData

Smile

CN(C)CCN(C)C1=CC(=C(C=C1NC(=O)C=C)NC2=NC=CC(=N2)N3C4=C(C=C(C=C4)CO)N(C3=O)C5CC5)OC

DOS

IR

Vibrations