Geometry & MOs

Info

ID:	263838
PubChem CID:	103401162
Reduced:	BrClNSF2H11C13 (1)
Stoich.:	ABCDE2F11G13 (1)
Weight, g/mol:	287.155515
ΔH_f, kcal/mol:	-54.01
Dipole, Da:	3.74
IP(EA), eV:	-9.16(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-methoxyethoxy)propoxy]-1-(3-methylthiophen-2-yl)propan-2-amine

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(C2=CC(=C(C=C2F)Br)F)NC

DOS

IR

Vibrations