Geometry & MOs

Info

ID:	276052
PubChem CID:	103820184
Reduced:	SN3O3C12H15 (1)
Stoich.:	AB3C3D12E15 (1)
Weight, g/mol:	284.132491
ΔH_f, kcal/mol:	-4.39
Dipole, Da:	10.19
IP(EA), eV:	-9.16(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1H-inden-2-ylamino)-N-(3-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC(C(CO)SC)NC1=CC(=C(C=C1)C#N)[N+](=O)[O-]

DOS

IR

Vibrations