Geometry & MOs

Info

ID:	305525
PubChem CID:	124958357
Reduced:	ON4C19H26 (1)
Stoich.:	AB4C19D26 (1)
Weight, g/mol:	379.214744
ΔH_f, kcal/mol:	22.4
Dipole, Da:	3.37
IP(EA), eV:	-9.04(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,5S,6S,8R,10R)-5-(2-hydroxynaphthalen-1-yl)-9,9-dimethyl-4-oxatricyclo[6.2.1.01,6]undecan-10-yl]acetamide

Drug info:

PubChemData

Smile

CCN1C=C(C(=N1)C)CN2CC3(C2)C[C@H](OC3)CC4=CN=CC=C4

DOS

IR

Vibrations