Geometry & MOs

Info

ID:	265181
PubChem CID:	103512889
Reduced:	NO3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	189.042593
ΔH_f, kcal/mol:	-83.73
Dipole, Da:	3.4
IP(EA), eV:	-9.27(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1-benzofuran-3-carbonyl isocyanate

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C(=O)N=C=O

DOS

IR

Vibrations