Geometry & MOs

Info

ID:	70678
PubChem CID:	48413710
Reduced:	O3N5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	417.262757
ΔH_f, kcal/mol:	-15.45
Dipole, Da:	5.86
IP(EA), eV:	-8.85(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(CN2CCOCC2)NC(=O)C3=CN=C(C=C3)N4C=CC=N4

DOS

IR

Vibrations