Geometry & MOs

Info

ID:	159425
PubChem CID:	57280129
Reduced:	NO2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	243.162314
ΔH_f, kcal/mol:	-34.53
Dipole, Da:	2.89
IP(EA), eV:	-8.81(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,9S,10R)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-trien-8-ol

Drug info:

PubChemData

Smile

CN(C)CC1=CC(=CC(=C1)CC2=CC=CC=C2)C(=O)COC

DOS

IR

Vibrations