Geometry & MOs

Info

ID:	352078
PubChem CID:	127283146
Reduced:	ON2C8H15 (2)
Stoich.:	AB2C8D15 (2)
Weight, g/mol:	369.186398
ΔH_f, kcal/mol:	-118.49
Dipole, Da:	4.21
IP(EA), eV:	-8.59(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2,4-difluorophenyl)ethyl]-N-(1,4-dioxan-2-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(CN1CCCC1=O)NC(=O)N(C)CC2CCN(CC2)C

DOS

IR

Vibrations