Geometry & MOs

Info

ID:	354674
PubChem CID:	127287373
Reduced:	N3O3C20H37 (1)
Stoich.:	A3B3C20D37 (1)
Weight, g/mol:	380.278741
ΔH_f, kcal/mol:	-167.9
Dipole, Da:	5.72
IP(EA), eV:	-8.62(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclohexanecarbonyl)-N-(3-morpholin-4-ylbutan-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)N2CCC(CC2)OC3CCCCC3

DOS

IR

Vibrations