Geometry & MOs

Info

ID:	339278
PubChem CID:	127260657
Reduced:	O2C11H18 (1)
Stoich.:	A2B11C18 (1)
Weight, g/mol:	250.076057
ΔH_f, kcal/mol:	-104.2
Dipole, Da:	4.22
IP(EA), eV:	-9.64(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6Z)-2-chloro-6-[(4-methoxyphenyl)methylidene]cyclohexan-1-one

Drug info:

PubChemData

Smile

CCCCC1CCC/C(=C\O)/C1=O

DOS

IR

Vibrations