Geometry & MOs

Info

ID:	420280
PubChem CID:	135112217
Reduced:	N2O3C18H32 (1)
Stoich.:	A2B3C18D32 (1)
Weight, g/mol:	405.206385
ΔH_f, kcal/mol:	-156.66
Dipole, Da:	2.86
IP(EA), eV:	-8.78(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1CCC[C@@]2(C1)CCC[C@H]2OC)N3CCOCC3

DOS

IR

Vibrations