Geometry & MOs

Info

ID:	198306
PubChem CID:	79084037
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	290.143743
ΔH_f, kcal/mol:	-74.13
Dipole, Da:	5.47
IP(EA), eV:	-8.78(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[chloro-[4-(2-methylbutan-2-yl)phenyl]methyl]-5-ethylfuran

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)N(CC(=NO)N)C2CCCC2

DOS

IR

Vibrations