Geometry & MOs

Info

ID:	371356
PubChem CID:	127345845
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-124.9
Dipole, Da:	5.46
IP(EA), eV:	-8.98(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[2-(oxolan-3-yl)acetyl]amino]phenyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CC2CCOC2)C(=O)N3CCCC3

DOS

IR

Vibrations