Geometry & MOs

Info

ID:	265185
PubChem CID:	103512925
Reduced:	O2N3H5C10 (1)
Stoich.:	A2B3C5D10 (1)
Weight, g/mol:	165.078979
ΔH_f, kcal/mol:	12.11
Dipole, Da:	2.91
IP(EA), eV:	-10.29(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bicyclo[2.2.1]heptane-2-carbonyl isocyanate

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1)N=CC=N2)C(=O)N=C=O

DOS

IR

Vibrations