Geometry & MOs

Info

ID:	353293
PubChem CID:	127284622
Reduced:	NO2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	296.148455
ΔH_f, kcal/mol:	-173.82
Dipole, Da:	4.43
IP(EA), eV:	-8.67(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[2-(3-methylmorpholin-4-yl)ethyl]-2,4-dioxopyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC1COCCN1CCNC(=O)C2COCCO2

DOS

IR

Vibrations