Geometry & MOs

Info

ID:	147847
PubChem CID:	53787505
Reduced:	N5O7C22H27 (1)
Stoich.:	A5B7C22D27 (1)
Weight, g/mol:	137.120449
ΔH_f, kcal/mol:	-245.5
Dipole, Da:	4.11
IP(EA), eV:	-9.79(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-azatricyclo[5.2.1.01,5]decane

Drug info:

PubChemData

Smile

CCCCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3C(NC3=O)C(=O)OC

DOS

IR

Vibrations