Geometry & MOs

Info

ID:	54934
PubChem CID:	17389563
Reduced:	KNO4C17H22 (1)
Stoich.:	ABC4D17E22 (1)
Weight, g/mol:	271.061136
ΔH_f, kcal/mol:	-227.62
Dipole, Da:	9.8
IP(EA), eV:	-8.67(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[(furan-2-ylmethylamino)methyl]furan-2-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

CC1=CC=CC=C1[C@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C(=O)[O-].[K+]

DOS

IR

Vibrations