Geometry & MOs

Info

ID:	209736
PubChem CID:	80710189
Reduced:	SN3O3C13H19 (1)
Stoich.:	AB3C3D13E19 (1)
Weight, g/mol:	279.147058
ΔH_f, kcal/mol:	-139.56
Dipole, Da:	1.64
IP(EA), eV:	-8.58(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[cyclopentyl-[3-(furan-2-yl)propanoyl]amino]acetate

Drug info:

PubChemData

Smile

C1CSCCC1CC(=O)N2CCC3(C2)C(=O)NC(=O)N3

DOS

IR

Vibrations