Geometry & MOs

Info

ID:	203922
PubChem CID:	79891054
Reduced:	S2N3O3C12H15 (1)
Stoich.:	A2B3C3D12E15 (1)
Weight, g/mol:	287.109233
ΔH_f, kcal/mol:	-67.18
Dipole, Da:	6.32
IP(EA), eV:	-8.62(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-2-N-(1-thiophen-2-ylpropan-2-yl)-1,3-benzoxazole-2,5-diamine

Drug info:

PubChemData

Smile

CS(=O)(=O)C1CSCCN1C2=NC3=C(O2)C=CC(=C3)N

DOS

IR

Vibrations