Geometry & MOs

Info

ID:	357974
PubChem CID:	127295488
Reduced:	N3O3C20H33 (1)
Stoich.:	A3B3C20D33 (1)
Weight, g/mol:	320.130697
ΔH_f, kcal/mol:	-177.68
Dipole, Da:	1.07
IP(EA), eV:	-9.42(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8lambda4-thia-7,9-diazabicyclo[4.3.0]nona-1(6),2,4,7,8-pentaen-2-yl)-2-[methyl(oxan-3-ylmethyl)amino]acetamide

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)CC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations