Geometry & MOs

Info

ID:	261912
PubChem CID:	103258758
Reduced:	FNO2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	283.095691
ΔH_f, kcal/mol:	-101.14
Dipole, Da:	5.88
IP(EA), eV:	-9.9(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(quinolin-8-ylmethylamino)methyl]-1,2-oxazole-3-carboxylic acid

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=CC=C1)F)NCC(=C)C(=O)O

DOS

IR

Vibrations