Geometry & MOs

Info

ID:	35928
PubChem CID:	7980511
Reduced:	ClNO5H16C21 (1)
Stoich.:	ABC5D16E21 (1)
Weight, g/mol:	409.108086
ΔH_f, kcal/mol:	-141.3
Dipole, Da:	2.4
IP(EA), eV:	-9.51(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[[2-[(4-chlorophenyl)methoxy]benzoyl]amino]acetate

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)COC(=O)C2=C(C3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl

DOS

IR

Vibrations