Geometry & MOs

Info

ID:	419236
PubChem CID:	135107811
Reduced:	O2F3N3C14H16 (1)
Stoich.:	A2B3C3D14E16 (1)
Weight, g/mol:	314.210661
ΔH_f, kcal/mol:	-146.39
Dipole, Da:	7.06
IP(EA), eV:	-9.31(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-(3-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)C(F)(F)F)CC2=NOC(=N2)COC

DOS

IR

Vibrations