Geometry & MOs

Info

ID:	441100
PubChem CID:	135233116
Reduced:	NC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	487.257003
ΔH_f, kcal/mol:	4.82
Dipole, Da:	2.55
IP(EA), eV:	-8.31(1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[(E)-5-[5-[3-(4-hexylfuran-2-yl)-2-methylpropanoyl]-4-hydroxy-6-oxopyran-2-yl]hex-1-enyl]carbamate

Drug info:

PubChemData

Smile

CCC(C)CN1CCC2=C(C1)NC=C2

DOS

IR

Vibrations