Geometry & MOs

Info

ID:	62469
PubChem CID:	26719755
Reduced:	ClO2S2N3H18C22 (1)
Stoich.:	AB2C2D3E18F22 (1)
Weight, g/mol:	263.071306
ΔH_f, kcal/mol:	-8.93
Dipole, Da:	2.3
IP(EA), eV:	-9.0(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2,4,5-trimethylfuran-3-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=CC(=CC=C1)Cl)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

DOS

IR

Vibrations