Geometry & MOs

Info

ID:	419115
PubChem CID:	135107534
Reduced:	O2N5C17H19 (1)
Stoich.:	A2B5C17D19 (1)
Weight, g/mol:	431.196883
ΔH_f, kcal/mol:	-32.38
Dipole, Da:	4.76
IP(EA), eV:	-9.15(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-methyl-N-[[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CC2(CCC3=CN=C(N=C32)N)CN(C1)C(=O)C4=CC=CC(=O)N4

DOS

IR

Vibrations