Geometry & MOs

Info

ID:	265188
PubChem CID:	103512955
Reduced:	NO3C8H11 (1)
Stoich.:	AB3C8D11 (1)
Weight, g/mol:	193.085127
ΔH_f, kcal/mol:	-122.28
Dipole, Da:	3.76
IP(EA), eV:	-9.98(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-diethylpyrazole-3-carbonyl isocyanate

Drug info:

PubChemData

Smile

C1CC(OC1)CCC(=O)N=C=O

DOS

IR

Vibrations