Geometry & MOs

Info

ID:	356728
PubChem CID:	127292209
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	390.145868
ΔH_f, kcal/mol:	-155.13
Dipole, Da:	2.43
IP(EA), eV:	-8.75(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-2-(1H-imidazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NCC2(CCCC2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations