Geometry & MOs

Info

ID:	234754
PubChem CID:	92303438
Reduced:	O2N4H18C19 (1)
Stoich.:	A2B4C18D19 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	33.6
Dipole, Da:	7.61
IP(EA), eV:	-8.85(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-benzylimidazol-2-yl)methyl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide

Drug info:

PubChemData

Smile

C1C(=CC2=CC=CC=C2O1)/C=C(/C#N)\C(=O)NCCCN3C=CN=C3

DOS

IR

Vibrations