Geometry & MOs

Info

ID:	360100
PubChem CID:	127300433
Reduced:	O2N4C19H32 (1)
Stoich.:	A2B4C19D32 (1)
Weight, g/mol:	294.137971
ΔH_f, kcal/mol:	-105.09
Dipole, Da:	1.28
IP(EA), eV:	-8.77(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-fluoro-3,4-dihydro-2H-chromen-4-yl)-2-methylmorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1COC(CN1C(=O)NC2CCC3=NC(=CN3C2)C(C)(C)C)C

DOS

IR

Vibrations