Geometry & MOs

Info

ID:	387476
PubChem CID:	134985517
Reduced:	NO3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	190.058971
ΔH_f, kcal/mol:	-30.09
Dipole, Da:	6.32
IP(EA), eV:	-9.23(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-nitro-2-nitrosobutanoate

Drug info:

PubChemData

Smile

CC1C(C(=O)C2=C1C(=CC=C2)OC)N=O

DOS

IR

Vibrations