Geometry & MOs

Info

ID:	23013
PubChem CID:	600877
Reduced:	NO4C19H21 (1)
Stoich.:	AB4C19D21 (1)
Weight, g/mol:	327.147058
ΔH_f, kcal/mol:	-134.41
Dipole, Da:	3.96
IP(EA), eV:	-9.02(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(4-butoxybenzoyl)amino]benzoate

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)OC

DOS

IR

Vibrations