Geometry & MOs

Info

ID:	383333
PubChem CID:	134975004
Reduced:	NO3H15C20 (1)
Stoich.:	AB3C15D20 (1)
Weight, g/mol:	359.115758
ΔH_f, kcal/mol:	-44.69
Dipole, Da:	5.12
IP(EA), eV:	-8.74(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(phenylcarbamoyl)benzo[e][1]benzofuran-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=O)C1(C2=C(C=CC3=CC=CC=C32)N(C1=O)C4=CC=CC=C4)O

DOS

IR

Vibrations