Geometry & MOs

Info

ID:	206838
PubChem CID:	80307305
Reduced:	S2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	294.122441
ΔH_f, kcal/mol:	70.31
Dipole, Da:	3.44
IP(EA), eV:	-8.05(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]-1-(3-ethylthiophen-2-yl)methanamine

Drug info:

PubChemData

Smile

CCSC1=CC(=CC2=C1C=CN2CC3=NC=CS3)N

DOS

IR

Vibrations