Geometry & MOs

Info

ID:	128778
PubChem CID:	51057543
Reduced:	NCl2O2H13C19 (1)
Stoich.:	AB2C2D13E19 (1)
Weight, g/mol:	312.990863
ΔH_f, kcal/mol:	-4.75
Dipole, Da:	4.92
IP(EA), eV:	-8.94(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(2,4-dichlorophenyl)furan-2-carbonyl]amino]acetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(O2)/C=C/C(=O)NC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations