Geometry & MOs

Info

ID:	247428
PubChem CID:	103071241
Reduced:	NC6H12 (2)
Stoich.:	AB6C12 (2)
Weight, g/mol:	238.240899
ΔH_f, kcal/mol:	-9.37
Dipole, Da:	1.54
IP(EA), eV:	-8.62(1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(3-propylpyrrolidin-1-yl)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CCC1CCN(C1)CC(=C)CNCC

DOS

IR

Vibrations