Geometry & MOs

Info

ID:	436951
PubChem CID:	135213236
Reduced:	ClC6H8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	262.146999
ΔH_f, kcal/mol:	-11.1
Dipole, Da:	3.06
IP(EA), eV:	-9.13(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclodecapentaenyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-amine

Drug info:

PubChemData

Smile

CC(C)/C(=C\C1=C(CCC1=C)CCl)/Cl

DOS

IR

Vibrations