Geometry & MOs

Info

ID:	263572
PubChem CID:	103379435
Reduced:	SN3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	242.120132
ΔH_f, kcal/mol:	41.09
Dipole, Da:	4.44
IP(EA), eV:	-8.36(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-[methyl(pentan-2-yl)amino]-1,2-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(C1CCCC1)C2=C(C(=NS2)N)C3=CC=CC=C3

DOS

IR

Vibrations