Geometry & MOs

Info

ID:	130195
PubChem CID:	51075211
Reduced:	ON3C20H21 (1)
Stoich.:	AB3C20D21 (1)
Weight, g/mol:	317.137556
ΔH_f, kcal/mol:	12.94
Dipole, Da:	5.39
IP(EA), eV:	-8.73(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-(3-methyl-1,2-oxazol-5-yl)propanamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CCC2=NC3=CC=CC=C3N2)C4=CC=CC=C4

DOS

IR

Vibrations