Geometry & MOs

Info

ID:	417384
PubChem CID:	135092972
Reduced:	ON3C19H25 (1)
Stoich.:	AB3C19D25 (1)
Weight, g/mol:	403.165582
ΔH_f, kcal/mol:	-30.42
Dipole, Da:	4.83
IP(EA), eV:	-8.22(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=C1)C(=CC(=N2)NCCC(=O)N3CCCC3)C)C

DOS

IR

Vibrations