Geometry & MOs

Info

ID:	343220
PubChem CID:	127266393
Reduced:	FSN2O2C14H19 (1)
Stoich.:	ABC2D2E14F19 (1)
Weight, g/mol:	332.221226
ΔH_f, kcal/mol:	-123.82
Dipole, Da:	5.62
IP(EA), eV:	-8.69(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-1-[2-(2-propan-2-ylimidazol-1-yl)acetyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC1=C(C=C(C=C1)C(=O)NC2(CCSCC2)CO)F

DOS

IR

Vibrations