Geometry & MOs

Info

ID:	421327
PubChem CID:	135115788
Reduced:	N3O6C31H35 (1)
Stoich.:	A3B6C31D35 (1)
Weight, g/mol:	346.262028
ΔH_f, kcal/mol:	-93.92
Dipole, Da:	3.28
IP(EA), eV:	-8.15(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-N-(1-adamantyl)-4-methoxy-7-azaspiro[4.5]decane-7-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C3C4=CC=C(C=C4)OCCOCCN(CC(=O)N3CCC2=C1)C(=O)CCC5=CN=CC=C5)OC

DOS

IR

Vibrations