Geometry & MOs

Info

ID:	371151
PubChem CID:	127342654
Reduced:	O3N5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	395.187878
ΔH_f, kcal/mol:	-61.59
Dipole, Da:	8.79
IP(EA), eV:	-9.2(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,1-dioxothiolan-3-yl)-methylamino]-N-[2-methyl-5-(morpholin-4-ylmethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2CCCN2C(=O)C3=CC=CC=C3O)CN4C=NC=N4

DOS

IR

Vibrations