Geometry & MOs

Info

ID:	75244
PubChem CID:	48423226
Reduced:	N4O5C21H30 (1)
Stoich.:	A4B5C21D30 (1)
Weight, g/mol:	339.215806
ΔH_f, kcal/mol:	-193.04
Dipole, Da:	4.83
IP(EA), eV:	-9.13(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)N2CCN(CC2)C(=O)CN3CCOCC3

DOS

IR

Vibrations