Geometry & MOs

Info

ID:	369996
PubChem CID:	127337084
Reduced:	OSN4C22H30 (1)
Stoich.:	ABC4D22E30 (1)
Weight, g/mol:	393.205242
ΔH_f, kcal/mol:	-16.14
Dipole, Da:	5.58
IP(EA), eV:	-8.18(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-dibenzofuran-3-yl-4-(oxan-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)NC3=CC=C(C=C3)SC4CCCC4

DOS

IR

Vibrations