Geometry & MOs

Info

ID:	128909
PubChem CID:	51063539
Reduced:	NO4H15C18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	341.126323
ΔH_f, kcal/mol:	-88.86
Dipole, Da:	9.06
IP(EA), eV:	-9.04(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 5-[(3-oxo-3-phenylpropyl)amino]benzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(O2)C(=O)CCNC3=CC=C(C=C3)C(=O)O

DOS

IR

Vibrations