Geometry & MOs

Info

ID:	408124
PubChem CID:	135080881
Reduced:	OSN3C11H13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	241.071448
ΔH_f, kcal/mol:	22.02
Dipole, Da:	5.14
IP(EA), eV:	-9.2(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(trifluoromethyl)-3H-inden-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CSC(=O)C(=N1)N2C=CN=C2C(C)C

DOS

IR

Vibrations