Geometry & MOs

Info

ID:	127634
PubChem CID:	51009467
Reduced:	NO2C18H23 (1)
Stoich.:	AB2C18D23 (1)
Weight, g/mol:	203.131014
ΔH_f, kcal/mol:	-39.41
Dipole, Da:	1.15
IP(EA), eV:	-9.15(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,4R)-1-methyl-2-pyridin-2-ylbicyclo[2.2.1]heptan-2-ol

Drug info:

PubChemData

Smile

CC1(OC[C@@H](O1)[C@@H]2[C@H]3C[C@@H](N2CC4=CC=CC=C4)C=C3)C

DOS

IR

Vibrations