Geometry & MOs

Info

ID:	21835
PubChem CID:	591813
Reduced:	NOC17H23 (1)
Stoich.:	ABC17D23 (1)
Weight, g/mol:	257.177964
ΔH_f, kcal/mol:	-45.76
Dipole, Da:	1.82
IP(EA), eV:	-8.62(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-3-ol

Drug info:

PubChemData

Smile

CN1CCC23CCCCC2C1CC4=C3C(=CC=C4)O

DOS

IR

Vibrations