Geometry & MOs

Info

ID:	293050
PubChem CID:	117372422
Reduced:	ClNO4C10H14 (1)
Stoich.:	ABC4D10E14 (1)
Weight, g/mol:	247.05124
ΔH_f, kcal/mol:	-156.76
Dipole, Da:	4.61
IP(EA), eV:	-8.92(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-1-methylindol-5-yl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

COC1=C(C(=C(C(=C1)O)Cl)C(CN)O)OC

DOS

IR

Vibrations