Geometry & MOs

Info

ID:	211912
PubChem CID:	81058807
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	257.246713
ΔH_f, kcal/mol:	-78.45
Dipole, Da:	5.02
IP(EA), eV:	-9.53(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N-methyl-1-propan-2-yl-N-(2-propan-2-yloxyethyl)pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C(C1=CC=CC=C1)Cl

DOS

IR

Vibrations