Geometry & MOs

Info

ID:	349968
PubChem CID:	127276773
Reduced:	O4N5C18H21 (1)
Stoich.:	A4B5C18D21 (1)
Weight, g/mol:	395.187878
ΔH_f, kcal/mol:	-150.26
Dipole, Da:	6.34
IP(EA), eV:	-8.33(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylsulfonylpiperidin-4-yl)methyl]-3-(morpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)NC(=O)C3CCC4(CC3)C(=O)NC(=O)N4)N(C1=O)C

DOS

IR

Vibrations