Geometry & MOs

Info

ID:	35864
PubChem CID:	7980418
Reduced:	N2O3H16C19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	337.092578
ΔH_f, kcal/mol:	-48.63
Dipole, Da:	2.48
IP(EA), eV:	-9.63(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[[3-(trifluoromethyl)benzoyl]amino]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)CNC(=O)C2=NC3=CC=CC=C3C=C2

DOS

IR

Vibrations