Geometry & MOs

Info

ID:	354621
PubChem CID:	127287238
Reduced:	O2N5C22H33 (1)
Stoich.:	A2B5C22D33 (1)
Weight, g/mol:	345.216475
ΔH_f, kcal/mol:	-48.15
Dipole, Da:	6.07
IP(EA), eV:	-8.54(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(methyl)amino]propyl]-4-(pyridine-2-carbonyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)N1CCN(CC1)CC(=O)N2CCC3=CC=CC=C32)N(C)C4CC4

DOS

IR

Vibrations