Geometry & MOs

Info

ID:	347115
PubChem CID:	127271619
Reduced:	FN3O4C17H22 (1)
Stoich.:	AB3C4D17E22 (1)
Weight, g/mol:	398.268176
ΔH_f, kcal/mol:	-200.87
Dipole, Da:	7.54
IP(EA), eV:	-9.24(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methylphenyl)cyclopropyl]methyl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCN(CC1)C(=O)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations