Geometry & MOs

Info

ID:	62073
PubChem CID:	26717440
Reduced:	SN2O6C22H22 (1)
Stoich.:	AB2C6D22E22 (1)
Weight, g/mol:	340.038148
ΔH_f, kcal/mol:	-156.99
Dipole, Da:	4.64
IP(EA), eV:	-8.38(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-oxoethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations