Geometry & MOs

Info

ID:	200006
PubChem CID:	79330439
Reduced:	ClN2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	27.64
Dipole, Da:	2.93
IP(EA), eV:	-9.06(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(dimethylamino)phenyl]bicyclo[3.1.0]hexan-6-ol

Drug info:

PubChemData

Smile

CCC(=CC1=CC2=CC=CC(=C2N=C1Cl)C)CNCC

DOS

IR

Vibrations