Geometry & MOs

Info

ID:	35879
PubChem CID:	7980439
Reduced:	ClNO4C18H18 (1)
Stoich.:	ABC4D18E18 (1)
Weight, g/mol:	297.136493
ΔH_f, kcal/mol:	-131.12
Dipole, Da:	1.88
IP(EA), eV:	-9.27(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[(2,5-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C(C=C1)Cl)NC(=O)COC(=O)COC2=CC=CC=C2

DOS

IR

Vibrations