Geometry & MOs

Info

ID:	417463
PubChem CID:	135094903
Reduced:	NSO3C21H21 (1)
Stoich.:	ABC3D21E21 (1)
Weight, g/mol:	268.189926
ΔH_f, kcal/mol:	-81.65
Dipole, Da:	5.61
IP(EA), eV:	-9.31(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[1-(2-methoxyethyl)imidazol-2-yl]methyl-methylamino]-N,2-dimethylpropanamide

Drug info:

PubChemData

Smile

C1CC(=O)C2=C1C(=CC=C2)C(=O)N3CCC4(CC3)C5=C(CCO4)SC=C5

DOS

IR

Vibrations