Geometry & MOs

Info

ID:	347606
PubChem CID:	127272461
Reduced:	ON8C19H24 (1)
Stoich.:	AB8C19D24 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	59.24
Dipole, Da:	4.4
IP(EA), eV:	-9.03(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)N[C@H](C)C2=NN=C3N2CCCCC3)C4=CC=CC=N4

DOS

IR

Vibrations