Geometry & MOs

Info

ID:	364644
PubChem CID:	127315939
Reduced:	NO2C15H19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-74.85
Dipole, Da:	5.61
IP(EA), eV:	-8.75(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzofuran-3-yl-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)C2COC3=CC=CC=C23)C

DOS

IR

Vibrations