Geometry & MOs

Info

ID:	202014
PubChem CID:	79619281
Reduced:	NO2C13H25 (1)
Stoich.:	AB2C13D25 (1)
Weight, g/mol:	267.267448
ΔH_f, kcal/mol:	-111.1
Dipole, Da:	5.27
IP(EA), eV:	-8.69(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-methyl-1-N-[(1-methylpyrrolidin-2-yl)methyl]-3-N-propylcyclohexane-1,3-diamine

Drug info:

PubChemData

Smile

CCC(C)N(CCOC)C1CCCC(=O)C1

DOS

IR

Vibrations