Geometry & MOs

Info

ID:	199901
PubChem CID:	79315737
Reduced:	SN3O3C13H23 (1)
Stoich.:	AB3C3D13E23 (1)
Weight, g/mol:	271.204848
ΔH_f, kcal/mol:	-137.12
Dipole, Da:	4.96
IP(EA), eV:	-8.85(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]phenyl]prop-2-yn-1-amine

Drug info:

PubChemData

Smile

CC1N(C(CS1)C(=O)O)C(=O)N(C)CC2CCCN2C

DOS

IR

Vibrations