Geometry & MOs

Info

ID:	350062
PubChem CID:	127276935
Reduced:	O3N4C21H26 (1)
Stoich.:	A3B4C21D26 (1)
Weight, g/mol:	361.200156
ΔH_f, kcal/mol:	-49.68
Dipole, Da:	8.63
IP(EA), eV:	-8.92(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1CN2CCOCC2)CC3=NC(=O)C4=C(N3)C5=CC=CC=C5O4

DOS

IR

Vibrations