Geometry & MOs

Info

ID:	275713
PubChem CID:	103817221
Reduced:	N3O3C12H17 (1)
Stoich.:	A3B3C12D17 (1)
Weight, g/mol:	299.067284
ΔH_f, kcal/mol:	-79.26
Dipole, Da:	7.29
IP(EA), eV:	-9.33(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-5-nitropyridin-3-yl)-(3,3-dimethylmorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

CCOC(=O)CN(C1CC1)C(=O)C2=CN(C=N2)C

DOS

IR

Vibrations