Geometry & MOs

Info

ID:	418388
PubChem CID:	135104495
Reduced:	FO2N3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	377.175084
ΔH_f, kcal/mol:	-87.41
Dipole, Da:	3.38
IP(EA), eV:	-9.05(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluoro-3-methoxyphenyl)-3-(3-pyrrolidin-1-ylbutylamino)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)CC2=CC(=O)C3=C(N2)C=CC(=C3)F

DOS

IR

Vibrations