Geometry & MOs

Info

ID:	348239
PubChem CID:	127273304
Reduced:	ClN3O4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	396.273656
ΔH_f, kcal/mol:	-165.57
Dipole, Da:	2.4
IP(EA), eV:	-9.12(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-3-(morpholine-4-carbonyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)NCCOC2=CC=C(C=C2)Cl)C(=O)N3CCOCC3

DOS

IR

Vibrations