Geometry & MOs

Info

ID:	263251
PubChem CID:	103349396
Reduced:	O2S2N5C12H15 (1)
Stoich.:	A2B2C5D12E15 (1)
Weight, g/mol:	315.01699
ΔH_f, kcal/mol:	10.93
Dipole, Da:	5.16
IP(EA), eV:	-8.82(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropylsulfonyl-5-N-(thiophen-2-ylmethyl)-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

C1CC1S(=O)(=O)C2=C(SN=C2N)N3CCN4C=CN=C4C3

DOS

IR

Vibrations