Geometry & MOs

Info

ID:	261429
PubChem CID:	103233471
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	-57.37
Dipole, Da:	6.88
IP(EA), eV:	-9.2(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,3-dihydro-1H-inden-5-ylamino)methyl]furan-3-carboxylic acid

Drug info:

PubChemData

Smile

CN(CCCN/C=C/C(=O)O)CC1=CC=CC=C1

DOS

IR

Vibrations