Geometry & MOs

Info

ID:	145333
PubChem CID:	53502004
Reduced:	FON5C18H24 (1)
Stoich.:	ABC5D18E24 (1)
Weight, g/mol:	346.203862
ΔH_f, kcal/mol:	-30.76
Dipole, Da:	4.58
IP(EA), eV:	-8.59(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[methyl(methylsulfonyl)amino]propyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)F

DOS

IR

Vibrations