Geometry & MOs

Info

ID:	58881
PubChem CID:	24715029
Reduced:	O2N3H13C19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	285.136493
ΔH_f, kcal/mol:	49.52
Dipole, Da:	3.59
IP(EA), eV:	-9.47(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[benzyl(cyclopropyl)amino]methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC3=CC(=NN3C(=C2)C(=O)O)C4=CC=CC=C4

DOS

IR

Vibrations