Geometry & MOs

Info

ID:	335875
PubChem CID:	127254737
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	406.200491
ΔH_f, kcal/mol:	-63.3
Dipole, Da:	4.9
IP(EA), eV:	-8.54(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(1-methylbenzimidazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CNC(=O)C2=CC(=O)C(=CN2)OC

DOS

IR

Vibrations