Geometry & MOs

Info

ID:	263913
PubChem CID:	103407291
Reduced:	Cl2O2S2N3C10H11 (1)
Stoich.:	A2B2C2D3E10F11 (1)
Weight, g/mol:	293.100499
ΔH_f, kcal/mol:	-30.19
Dipole, Da:	9.58
IP(EA), eV:	-9.54(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-methylthiophen-2-yl)-N-methyl-1-(3-propylphenyl)methanamine

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C2=NN=C(N2C(C)C)S(=O)(=O)Cl

DOS

IR

Vibrations