Geometry & MOs

Info

ID:	74237
PubChem CID:	48421618
Reduced:	NO3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	254.163043
ΔH_f, kcal/mol:	-118.76
Dipole, Da:	2.36
IP(EA), eV:	-9.32(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-acetylpiperazin-1-yl)-2-(cyclopropylmethoxy)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCOCC1)OCC2CC2

DOS

IR

Vibrations