Geometry & MOs

Info

ID:	358563
PubChem CID:	127296195
Reduced:	FN2O2C22H31 (1)
Stoich.:	AB2C2D22E31 (1)
Weight, g/mol:	336.184921
ΔH_f, kcal/mol:	-130.85
Dipole, Da:	4.5
IP(EA), eV:	-9.41(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(4-fluorophenyl)oxan-4-yl]amino]-N-(oxan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC(C1CC2CCC1C2)NC(=O)CNC3(CCOCC3)C4=CC=C(C=C4)F

DOS

IR

Vibrations