Geometry & MOs

Info

ID:	6064
PubChem CID:	14387
Reduced:	OSN3C15H21 (1)
Stoich.:	ABC3D15E21 (1)
Weight, g/mol:	291.140533
ΔH_f, kcal/mol:	18.23
Dipole, Da:	2.88
IP(EA), eV:	-8.4(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-(1,3-thiazol-2-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CN(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CS2

DOS

IR

Vibrations