Geometry & MOs

Info

ID:	364645
PubChem CID:	127315940
Reduced:	N3O3C19H21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-49.11
Dipole, Da:	2.97
IP(EA), eV:	-9.1(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-benzofuran-3-carbonyl)piperazin-1-yl]-N-cyclohexylacetamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)C3=COC4=CC=CC=C43)C

DOS

IR

Vibrations