Geometry & MOs

Info

ID:	351265
PubChem CID:	127280153
Reduced:	N3O4C21H29 (1)
Stoich.:	A3B4C21D29 (1)
Weight, g/mol:	359.232125
ΔH_f, kcal/mol:	-138.81
Dipole, Da:	7.18
IP(EA), eV:	-8.9(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[4-(4-methylpyrimidine-5-carbonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)C3=C4C(=CC=C3)OCO4

DOS

IR

Vibrations