Geometry & MOs

Info

ID:	182896
PubChem CID:	76952010
Reduced:	O2N5C11H21 (1)
Stoich.:	A2B5C11D21 (1)
Weight, g/mol:	195.125929
ΔH_f, kcal/mol:	-24.37
Dipole, Da:	3.46
IP(EA), eV:	-8.6(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)but-2-en-1-one

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C(=NO)N)N(CCO)C(C)C)C

DOS

IR

Vibrations