Geometry & MOs

Info

ID:	207739
PubChem CID:	80444020
Reduced:	OSN3C16H25 (1)
Stoich.:	ABC3D16E25 (1)
Weight, g/mol:	323.14899
ΔH_f, kcal/mol:	-9.18
Dipole, Da:	3.07
IP(EA), eV:	-8.49(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butan-2-yl-5-(ethylaminomethyl)-N-methyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCC(C)C1=C(SC(=N1)N(C)CC2=CC=C(O2)C)CNC

DOS

IR

Vibrations