Geometry & MOs

Info

ID:	126165
PubChem CID:	50954253
Reduced:	O2N5C17H19 (1)
Stoich.:	A2B5C17D19 (1)
Weight, g/mol:	372.288912
ΔH_f, kcal/mol:	19.11
Dipole, Da:	4.68
IP(EA), eV:	-8.96(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylphenyl)methyl]-3-[4-[(1-methylpiperidin-4-yl)methyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=C(O2)C(=O)N3CCC(CC3)C4=NNN=N4)C

DOS

IR

Vibrations