Geometry & MOs

Info

ID:	208388
PubChem CID:	80526824
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	307.116149
ΔH_f, kcal/mol:	46.87
Dipole, Da:	1.79
IP(EA), eV:	-9.1(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-chlorophenyl)propyl]-2-methyl-2-thiophen-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)CNCC(C)(C)C2=CC=CS2

DOS

IR

Vibrations