Geometry & MOs

Info

ID:	424194
PubChem CID:	135121708
Reduced:	N2O2Cl4H22C25 (1)
Stoich.:	A2B2C4D22E25 (1)
Weight, g/mol:	420.168522
ΔH_f, kcal/mol:	-62.81
Dipole, Da:	1.68
IP(EA), eV:	-9.43(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl 4-[[1-(furan-2-carbonylamino)-2-(4-methylphenyl)-2-oxoethyl]amino]benzoate

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)CC2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4.Cl

DOS

IR

Vibrations