Geometry & MOs

Info

ID:	417502
PubChem CID:	135096149
Reduced:	OSN5C20H23 (1)
Stoich.:	ABC5D20E23 (1)
Weight, g/mol:	249.147727
ΔH_f, kcal/mol:	23.88
Dipole, Da:	3.55
IP(EA), eV:	-8.5(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-(1H-imidazol-2-ylmethyl)spiro[2.3]hexane-2-carboxamide

Drug info:

PubChemData

Smile

CSC1=NC(=CC(=N1)N2CCC3(CC2)C4=C(CCO3)C5=CC=CC=C5N4)N

DOS

IR

Vibrations