Geometry & MOs

Info

ID:	35883
PubChem CID:	7980444
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	405.05757
ΔH_f, kcal/mol:	-134.34
Dipole, Da:	6.25
IP(EA), eV:	-9.18(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[4-(4-bromophenoxy)butanoylamino]acetate

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations