Geometry & MOs

Info

ID:	369509
PubChem CID:	127334251
Reduced:	O3N5C20H33 (1)
Stoich.:	A3B5C20D33 (1)
Weight, g/mol:	320.184841
ΔH_f, kcal/mol:	-100.91
Dipole, Da:	3.83
IP(EA), eV:	-8.71(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-morpholin-4-ylacetyl)piperazine-1-carbonyl]cyclobutane-1-carbonitrile

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)N1CCN(CC1)CC2=NOC(=C2)C)NC(=O)N3CCCC3

DOS

IR

Vibrations