Geometry & MOs

Info

ID:	197792
PubChem CID:	78996971
Reduced:	ClSN4O4C11H11 (1)
Stoich.:	ABC4D4E11F11 (1)
Weight, g/mol:	279.1987
ΔH_f, kcal/mol:	-123.14
Dipole, Da:	7.25
IP(EA), eV:	-10.2(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,5-dimethylphenyl)ethyl]-6-methyl-2,3-dihydro-1H-inden-1-amine

Drug info:

PubChemData

Smile

C1CN(CC12C(=O)NC(=O)N2)S(=O)(=O)C3=C(N=CC=C3)Cl

DOS

IR

Vibrations