Geometry & MOs

Info

ID:	416316
PubChem CID:	135089329
Reduced:	ClNO3C19H26 (1)
Stoich.:	ABC3D19E26 (1)
Weight, g/mol:	317.106168
ΔH_f, kcal/mol:	-134.11
Dipole, Da:	3.1
IP(EA), eV:	-9.03(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-N-methylpyridin-2-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)N2CCC[C@@]3(C2)CCC[C@H]3OC)Cl

DOS

IR

Vibrations