Geometry & MOs

Info

ID:	365144
PubChem CID:	127316948
Reduced:	N2O2C25H36 (1)
Stoich.:	A2B2C25D36 (1)
Weight, g/mol:	355.225977
ΔH_f, kcal/mol:	-106.71
Dipole, Da:	3.29
IP(EA), eV:	-8.99(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-[[4-(1-phenylethylamino)oxan-4-yl]methyl]cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC2(CCOCC2)CNC(=O)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations