Geometry & MOs

Info

ID:	358435
PubChem CID:	127296003
Reduced:	O2N4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	364.283826
ΔH_f, kcal/mol:	-102.97
Dipole, Da:	7.07
IP(EA), eV:	-8.97(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(azepan-1-yl)-1-oxopropan-2-yl]-N-cyclohexylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCCC1)N2CCN(CC2)C(=O)NC

DOS

IR

Vibrations