Geometry & MOs

Info

ID:	204750
PubChem CID:	80003211
Reduced:	N2O6C13H18 (1)
Stoich.:	A2B6C13D18 (1)
Weight, g/mol:	262.111756
ΔH_f, kcal/mol:	-233.73
Dipole, Da:	6.54
IP(EA), eV:	-10.0(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(aminomethyl)-N-[(3-fluoro-4-methylphenyl)methyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)CCN(C)C(=O)NCC1=CC=C(O1)C(=O)O

DOS

IR

Vibrations