Geometry & MOs

Info

ID:	273374
PubChem CID:	103770986
Reduced:	NSCl2O2C15H17 (1)
Stoich.:	ABC2D2E15F17 (1)
Weight, g/mol:	309.113171
ΔH_f, kcal/mol:	-91.22
Dipole, Da:	1.88
IP(EA), eV:	-9.12(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2-hydroxy-4-methylpentyl)-3-methyl-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl)O

DOS

IR

Vibrations