Geometry & MOs

Info

ID:	61238
PubChem CID:	26707269
Reduced:	N3O4C22H25 (1)
Stoich.:	A3B4C22D25 (1)
Weight, g/mol:	473.178456
ΔH_f, kcal/mol:	-151.6
Dipole, Da:	3.2
IP(EA), eV:	-8.91(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[2-(cyclopentylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

DOS

IR

Vibrations