Geometry & MOs

Info

ID:	79895
PubChem CID:	49831099
Reduced:	O3C10H16 (2)
Stoich.:	A3B10C16 (2)
Weight, g/mol:	223.121331
ΔH_f, kcal/mol:	-132.05
Dipole, Da:	6.39
IP(EA), eV:	-9.24(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-[3-(dimethylamino)propyl]-N-propylcarbamate;hydrochloride

Drug info:

PubChemData

Smile

CCCCC[C@@H](/C=C/[C@@H]1[C@@H]2C[C@H]([C@H]1C/C=C\CCCC(=O)O)OO2)OO

DOS

IR

Vibrations