Geometry & MOs

Info

ID:	202879
PubChem CID:	79737923
Reduced:	N2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	235.112777
ΔH_f, kcal/mol:	-42.03
Dipole, Da:	3.94
IP(EA), eV:	-9.29(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorocyclohexen-1-yl)methyl]-5-ethylpyridine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1C(=O)O)CC2=NC=CN2C

DOS

IR

Vibrations