Geometry & MOs

Info

ID:	350316
PubChem CID:	127277394
Reduced:	NO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	359.257277
ΔH_f, kcal/mol:	-129.13
Dipole, Da:	2.11
IP(EA), eV:	-9.6(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclohexyl-2-hydroxyethyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CNC(=O)C2=CC3=C(COC3)C=C2)O

DOS

IR

Vibrations