Geometry & MOs

Info

ID:	359874
PubChem CID:	127299918
Reduced:	O4N5C17H27 (1)
Stoich.:	A4B5C17D27 (1)
Weight, g/mol:	394.294391
ΔH_f, kcal/mol:	-103.65
Dipole, Da:	4.48
IP(EA), eV:	-9.22(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylmethyl)-2-[4-(1-morpholin-4-yl-1-oxopropan-2-yl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)CN2CCN(CC2)C(C)C(=O)N3CCOCC3

DOS

IR

Vibrations