Geometry & MOs

Info

ID:	74388
PubChem CID:	48421804
Reduced:	NO4C16H23 (1)
Stoich.:	AB4C16D23 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-132.47
Dipole, Da:	2.92
IP(EA), eV:	-8.38(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)OCC2CC2

DOS

IR

Vibrations