Geometry & MOs

Info

ID:	273266
PubChem CID:	103770790
Reduced:	SO2N5C12H17 (1)
Stoich.:	AB2C5D12E17 (1)
Weight, g/mol:	282.157957
ΔH_f, kcal/mol:	-0.89
Dipole, Da:	6.26
IP(EA), eV:	-9.86(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-hydroxy-4-methylpentyl)amino]-3-oxopropyl]furan-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=C(C=CS1)N2C=NN=N2)O

DOS

IR

Vibrations