Geometry & MOs

Info

ID:	202899
PubChem CID:	79741284
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	246.173213
ΔH_f, kcal/mol:	-77.98
Dipole, Da:	5.91
IP(EA), eV:	-8.58(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-amino-2,3-dihydro-1H-inden-1-yl)-2-ethylbutanamide

Drug info:

PubChemData

Smile

C1CC2=C(C1NC(=O)C3CCOC3)C=CC(=C2)N

DOS

IR

Vibrations