Geometry & MOs

Info

ID:	205468
PubChem CID:	80109163
Reduced:	NO3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	248.116092
ΔH_f, kcal/mol:	-71.27
Dipole, Da:	4.84
IP(EA), eV:	-9.15(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[2-(oxetan-3-ylamino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C=CC(=O)NC2COC2

DOS

IR

Vibrations