Geometry & MOs

Info

ID:	196207
PubChem CID:	78797779
Reduced:	O2F3N5H14C17 (1)
Stoich.:	A2B3C5D14E17 (1)
Weight, g/mol:	395.130363
ΔH_f, kcal/mol:	-119.5
Dipole, Da:	5.18
IP(EA), eV:	-9.46(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)N2N=C(N=N2)C3=CC=CC=C3

DOS

IR

Vibrations