Geometry & MOs

Info

ID:	280726
PubChem CID:	103850978
Reduced:	NSO3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	273.103479
ΔH_f, kcal/mol:	-130.25
Dipole, Da:	2.52
IP(EA), eV:	-8.39(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-5-(methylsulfanylmethyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)SCCC(=O)NC(CCO)COC

DOS

IR

Vibrations