Geometry & MOs

Info

ID:	349771
PubChem CID:	127276163
Reduced:	O2N3C14H23 (1)
Stoich.:	A2B3C14D23 (1)
Weight, g/mol:	238.168128
ΔH_f, kcal/mol:	-84.38
Dipole, Da:	6.19
IP(EA), eV:	-8.93(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-cyclopropylpiperazin-1-yl)-(oxan-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=NC=CN1CC(C)CNC(=O)C2CCCOC2

DOS

IR

Vibrations