Geometry & MOs

Info

ID:	370881
PubChem CID:	127341205
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	385.203528
ΔH_f, kcal/mol:	-84.97
Dipole, Da:	4.73
IP(EA), eV:	-9.44(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-(1,1-dioxothiolan-3-yl)-2-(2-ethyl-3-oxopiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCC1C(=O)NCCN1CC(=O)NC(C2CCCC2)C3=CC=CC=C3

DOS

IR

Vibrations