Geometry & MOs

Info

ID:	370904
PubChem CID:	127341240
Reduced:	O2N3C16H27 (1)
Stoich.:	A2B3C16D27 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-84.18
Dipole, Da:	3.94
IP(EA), eV:	-9.14(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-(2-ethyl-3-oxopiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCC1C(=O)NCCN1CC(=O)N(C2CCCC2)C3CC3

DOS

IR

Vibrations