Geometry & MOs

Info

ID:	201120
PubChem CID:	79490590
Reduced:	S2N3C16H25 (1)
Stoich.:	A2B3C16D25 (1)
Weight, g/mol:	302.18167
ΔH_f, kcal/mol:	44.49
Dipole, Da:	2.05
IP(EA), eV:	-8.79(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[[methyl(2-thiophen-2-ylethyl)amino]methyl]phenyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCCNCC1=NC(=CS1)CN(C)C(C)CC2=CC=CS2

DOS

IR

Vibrations