Geometry & MOs

Info

ID:	139208
PubChem CID:	52492662
Reduced:	ClO2F3N3H17C18 (1)
Stoich.:	AB2C3D3E17F18 (1)
Weight, g/mol:	365.210327
ΔH_f, kcal/mol:	-228.11
Dipole, Da:	11.86
IP(EA), eV:	-9.01(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-[(4-methylphenyl)methyl]amino]-N-(ethylcarbamoyl)acetamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC=C1)NC(=O)C)NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F

DOS

IR

Vibrations