Geometry & MOs

Info

ID:	295656
PubChem CID:	117541544
Reduced:	NOH3C4 (3)
Stoich.:	ABC3D4 (3)
Weight, g/mol:	243.064391
ΔH_f, kcal/mol:	-49.07
Dipole, Da:	5.57
IP(EA), eV:	-8.62(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-(1H-indol-3-yl)-1,3-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C3=C(N=C(O3)N)C(=O)O

DOS

IR

Vibrations