Geometry & MOs

Info

ID:	233631
PubChem CID:	91146485
Reduced:	N2O8C25H46 (1)
Stoich.:	A2B8C25D46 (1)
Weight, g/mol:	310.153741
ΔH_f, kcal/mol:	-451.81
Dipole, Da:	4.46
IP(EA), eV:	-9.96(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine;2,2-dimethylpropane

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)OCC(C)OC(=O)[C@H]([C@@H](C)CC)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations