Geometry & MOs

Info

ID:	295752
PubChem CID:	117543635
Reduced:	NO3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	176.096793
ΔH_f, kcal/mol:	-95.02
Dipole, Da:	3.55
IP(EA), eV:	-8.75(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-1-cyclohexylpropan-2-ol

Drug info:

PubChemData

Smile

CC1=C(N(C=C1)CC2=CC(=C(C=C2)OC)C)C(=O)O

DOS

IR

Vibrations