Geometry & MOs

Info

ID:	267085
PubChem CID:	103580715
Reduced:	BrN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	279.147058
ΔH_f, kcal/mol:	-44.66
Dipole, Da:	2.37
IP(EA), eV:	-9.22(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[1-[(2-cyclopropyloxolan-3-yl)amino]ethyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

C1CC1C2C(CCO2)NCC(=O)NC3=CC=CC=C3Br

DOS

IR

Vibrations