Geometry & MOs

Info

ID:	404182
PubChem CID:	135065366
Reduced:	ClON2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	222.081143
ΔH_f, kcal/mol:	-14.76
Dipole, Da:	2.65
IP(EA), eV:	-9.32(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2E)-2-[(4-chlorophenyl)methylidene]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=NN1C(=O)C(C)CC2=CC=C(C=C2)Cl)C

DOS

IR

Vibrations