Geometry & MOs

Info

ID:	245530
PubChem CID:	99453684
Reduced:	N2O2C25H38 (1)
Stoich.:	A2B2C25D38 (1)
Weight, g/mol:	413.210327
ΔH_f, kcal/mol:	-118.14
Dipole, Da:	5.88
IP(EA), eV:	-9.17(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[cyclopentyl(2-phenylethyl)carbamoyl]phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CN(C1CCCCC1)C(=O)C2CCN(CC2)C(=O)CCC3=CC=CC=C3

DOS

IR

Vibrations