Geometry & MOs

Info

ID:	1175
PubChem CID:	3912
Reduced:	NOC19H25 (1)
Stoich.:	ABC19D25 (1)
Weight, g/mol:	283.193614
ΔH_f, kcal/mol:	-29.4
Dipole, Da:	1.08
IP(EA), eV:	-8.58(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

17-prop-2-enyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol

Drug info:

PubChemData

Smile

C=CCN1CCC23CCCCC2C1CC4=C3C=C(C=C4)O

DOS

IR

Vibrations