Geometry & MOs

Info

ID:	263247
PubChem CID:	103349256
Reduced:	OS2N4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	303.107519
ΔH_f, kcal/mol:	12.59
Dipole, Da:	6.72
IP(EA), eV:	-8.22(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-butyl-4-cyclopropylsulfonyl-5-N-ethyl-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

CCOC1CCCN(C1)C2=C(C(=NS2)N)C3=NC(=CS3)C

DOS

IR

Vibrations