Geometry & MOs

Info

ID:	251823
PubChem CID:	103107182
Reduced:	BrOSN2C11H17 (1)
Stoich.:	ABCD2E11F17 (1)
Weight, g/mol:	280.134241
ΔH_f, kcal/mol:	-24.68
Dipole, Da:	3.92
IP(EA), eV:	-9.05(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NCC1=C(C=CS1)Br

DOS

IR

Vibrations