Geometry & MOs

Info

ID:	126213
PubChem CID:	50955599
Reduced:	FNO2C12H18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	363.169525
ΔH_f, kcal/mol:	-123.26
Dipole, Da:	0.82
IP(EA), eV:	-8.91(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-[(5-cyanopyridin-2-yl)carbamoyl]phenyl]methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1F)CC(CO)O

DOS

IR

Vibrations