Geometry & MOs

Info

ID:	225477
PubChem CID:	85852491
Reduced:	ON3C10H13 (1)
Stoich.:	AB3C10D13 (1)
Weight, g/mol:	183.125929
ΔH_f, kcal/mol:	14.35
Dipole, Da:	4.97
IP(EA), eV:	-9.3(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-isocyano-3,3-dimethylpentanoate

Drug info:

PubChemData

Smile

C=C1C=NC(=NC1=O)N2CCCCC2

DOS

IR

Vibrations