Geometry & MOs

Info

ID:	201119
PubChem CID:	79490124
Reduced:	ClNOSC17H22 (1)
Stoich.:	ABCDE17F22 (1)
Weight, g/mol:	323.14899
ΔH_f, kcal/mol:	-19.13
Dipole, Da:	3.28
IP(EA), eV:	-8.86(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[[2-(propylaminomethyl)-1,3-thiazol-4-yl]methyl]-1-thiophen-2-ylpropan-2-amine

Drug info:

PubChemData

Smile

CC(CC1=CC=CS1)N(C)CCC(C2=CC(=CC=C2)Cl)O

DOS

IR

Vibrations