Geometry & MOs

Info

ID:	3007
PubChem CID:	9036
Reduced:	NOC19H25 (1)
Stoich.:	ABC19D25 (1)
Weight, g/mol:	283.193614
ΔH_f, kcal/mol:	-25.88
Dipole, Da:	1.07
IP(EA), eV:	-8.58(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,9S,10R)-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=CCN1CC[C@]23CCCC[C@H]2[C@@H]1CC4=C3C=C(C=C4)O

DOS

IR

Vibrations