Geometry & MOs

Info

ID:	260421
PubChem CID:	103190692
Reduced:	SN2O3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	216.220164
ΔH_f, kcal/mol:	-97.08
Dipole, Da:	6.57
IP(EA), eV:	-8.92(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(dimethylamino)propan-2-yl-ethylamino]pentan-2-ol

Drug info:

PubChemData

Smile

CCN(C(C)CN(C)C)C(=O)C1=CSC(=C1)/C=C/C(=O)O

DOS

IR

Vibrations