Geometry & MOs

Info

ID:	153939
PubChem CID:	56313289
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	354.176585
ΔH_f, kcal/mol:	-108.89
Dipole, Da:	4.83
IP(EA), eV:	-8.79(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfanyl-N-(3-phenylbutyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1CCN(CC1)C(=O)CCOC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations