Geometry & MOs

Info

ID:	278024
PubChem CID:	103832820
Reduced:	ON2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	272.188863
ΔH_f, kcal/mol:	-80.19
Dipole, Da:	3.45
IP(EA), eV:	-9.07(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methylphenyl)pyrrolidin-1-yl]-[(2R)-piperidin-2-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C2CCCN2C(=O)[C@@H]3CCCCN3

DOS

IR

Vibrations