Geometry & MOs

Info

ID:	331850
PubChem CID:	127250136
Reduced:	O2N3C25H33 (1)
Stoich.:	A2B3C25D33 (1)
Weight, g/mol:	425.247855
ΔH_f, kcal/mol:	-48.64
Dipole, Da:	3.39
IP(EA), eV:	-8.93(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[2-[5-[(2-fluorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCOC(C2)C3=NC=C(C=C3)CC4=CC=CC=C4

DOS

IR

Vibrations