Geometry & MOs

Info

ID:	200662
PubChem CID:	79424103
Reduced:	OC13H24 (1)
Stoich.:	AB13C24 (1)
Weight, g/mol:	253.146664
ΔH_f, kcal/mol:	-76.84
Dipole, Da:	2.1
IP(EA), eV:	-10.07(2.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(pyridin-2-ylmethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol

Drug info:

PubChemData

Smile

CCC1CCC(C(C1)CCC2CC2)O

DOS

IR

Vibrations