Geometry & MOs

Info

ID:	16597
PubChem CID:	473554
Reduced:	ClN2O4H19C22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	410.103335
ΔH_f, kcal/mol:	-103.91
Dipole, Da:	6.42
IP(EA), eV:	-9.22(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(5-chloro-2-phenoxyphenyl)carbamoylamino]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3

DOS

IR

Vibrations