Geometry & MOs

Info

ID:	205396
PubChem CID:	80095162
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	224.096793
ΔH_f, kcal/mol:	-47.65
Dipole, Da:	2.72
IP(EA), eV:	-8.86(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-chlorocyclohexyl)methyl]phenol

Drug info:

PubChemData

Smile

C1CCC(CC(C1)CC2=CC=C(C=C2)O)N

DOS

IR

Vibrations