Geometry & MOs

Info

ID:	27121
PubChem CID:	814445
Reduced:	ClN3O3C15H16 (1)
Stoich.:	AB3C3D15E16 (1)
Weight, g/mol:	307.072369
ΔH_f, kcal/mol:	-59.69
Dipole, Da:	4.73
IP(EA), eV:	-9.48(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=NOC(=C1)C)C(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations