Geometry & MOs

Info

ID:	349792
PubChem CID:	127276184
Reduced:	FN3O3C19H22 (1)
Stoich.:	AB3C3D19E22 (1)
Weight, g/mol:	324.204907
ΔH_f, kcal/mol:	-99.86
Dipole, Da:	7.01
IP(EA), eV:	-9.65(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(oxane-3-carbonyl)amino]ethyl]oxane-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2CCCOC2)C3=NC(=NO3)C4=CC(=CC=C4)F

DOS

IR

Vibrations