Geometry & MOs

Info

ID:	50526
PubChem CID:	12013071
Reduced:	C17H30 (1)
Stoich.:	A17B30 (1)
Weight, g/mol:	222.082684
ΔH_f, kcal/mol:	-37.58
Dipole, Da:	0.36
IP(EA), eV:	-8.83(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylimino-1,3-benzothiazol-3-yl)propan-2-ol

Drug info:

PubChemData

Smile

CCCCC/C=C\C1=CCC(CC1)C(C)(C)C

DOS

IR

Vibrations