Geometry & MOs

Info

ID:	362205
PubChem CID:	127307218
Reduced:	SO2N4C18H28 (1)
Stoich.:	AB2C4D18E28 (1)
Weight, g/mol:	373.200156
ΔH_f, kcal/mol:	-72.13
Dipole, Da:	2.04
IP(EA), eV:	-8.63(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(pyrrolidine-1-carbonyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)N3C4CCC3CC(C4)O

DOS

IR

Vibrations