Geometry & MOs

Info

ID:	147089
PubChem CID:	53786742
Reduced:	ON2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	380.117922
ΔH_f, kcal/mol:	-37.53
Dipole, Da:	3.08
IP(EA), eV:	-8.97(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4R)-4-(4-chlorophenyl)cyclohexen-1-yl]-3-methoxynaphthalene-1,4-diol

Drug info:

PubChemData

Smile

CC(=O)NC1CCN(C1)CCC2=CC=CC=C2

DOS

IR

Vibrations